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Profile: Shanghai Zhanshu Chemical Technology Co., Ltd. specializes in supplying biologically active and natural compounds. We offer biologically active compounds such as amentoflavone, bufogenin, guan-fu base hydrochloride, imidocarb dipropionate, pranoprofen, staurosporine and tiliroside. Our natural compounds include acetyl corynoline, acetyl shikonin, aesculetin, alantolactone, allomatrine, andrographolide, apiosylskimmin, arjunic acid, berbamine, carnosic acid and dehydrocostuslactone.

1 to 50 of 228 Products/Chemicals (Click for related suppliers)  Page: [1] 2 3 4 5 >> Next 50 Results
• Acetylshikonin
IUPAC Name: [1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate | CAS Registry Number: 24502-78-1
Synonyms: Shikonin, acetyl, Acetylalkannin, Alkannin, monoacetate, ARNEBIN 3, ARNEBIN-3, ALKANNIN MONOACETATE, NSC 110199, NSC110199, NSC140376, NSC291844, LS-95641, B671806K005, 1,4-Naphthoquinone, 5,8-dihydroxy-2-(1-hydroxy-4-methyl-3-pentenyl)-, 2-acetate, (+)-, (+)-5,8-Dihydroxy-2-(1-hydroxy-4-methyl-3-pentenyl)-1,4-naphthoquinone 2-acetate, 54984-93-9, 1,4-Naphthalenedione, 2-(1-(acetyloxy)-4-methyl-3-pentenyl)-5,8-dihydroxy-, 1,4-Naphthalenedione, 2-(1-(acetyloxy)-4-methyl-3-pentenyl)-5,8-dihydroxy-, (R)-, 1,4-Naphthalenedione, 2-(1-(acetyloxy)-4-methyl-3-pentenyl)-5,8-dihydroxy-, (R)- (9CI), 1,4-Naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-, 1,4-Naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-, (R)-

Molecular Formula: C18H18O6Molecular Weight: 330.331920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: WNFXUXZJJKTDOZ-UHFFFAOYSA-N

• Aconitine
Synonyms: aconitine, CHEBI:2430, NSC56464, STOCK1N-54397, CID245005, NCI60_004380, C06091, 16-Ethyl-1alpha,6alpha,19beta-trimethoxy-4-(methoxymethyl)-aconitane-3alpha,8,10alpha,11,18alpha-pentol, 8-acetate 10-benzoate, 20-ethyl-3alpha,13,15alpha-trihydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)aconitane-8,14alpha-diyl 8-acetate 14-benzoate

Molecular Formula: C34H47NO11Molecular Weight: 645.737080 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 12

InChIKey: XFSBVAOIAHNAPC-XTHSEXKGSA-N

• Acteoside
IUPAC Name: [(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 61276-17-3
Synonyms: Verbascoside, Kusaginin, MLS002473233, TJC 160, AIDS030638, NSC 603831, AIDS-030638, C29H36O15, NSC603831, CID5281800, LS-71509, SMR001397320, C10501, (B864379), Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-, .beta.-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl3-O-(6-deoxy-.alpha.-L-mannopyranosyl)-, 4-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate], 22323-52-0, 27625-92-9, Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-,4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-

Molecular Formula: C29H36O15Molecular Weight: 624.587140 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 15

InChIKey: FBSKJMQYURKNSU-ZLSOWSIRSA-N

• Alantolactone
IUPAC Name: (3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-5,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one | CAS Registry Number: 546-43-0
Synonyms: helenine, Eupatal, Alant camphor, Inula camphor, helenin, Elecampane camphor, Spectrum_000297, Spectrum2_000297, Spectrum3_001358, Spectrum4_001772, Spectrum5_000383, BSPBio_003175, KBioGR_002284, KBioSS_000777, SPECTRUM310010, NSC93131, SPBio_000234, CHEBI:2540, STOCK1N-11111, EINECS 208-899-3

Molecular Formula: C15H20O2Molecular Weight: 232.318100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PXOYOCNNSUAQNS-AGNJHWRGSA-N

• Albiflorin
Synonyms: 9-((Benzoyloxy)methyl)-1-(beta-D-glucopyranosyloxy)-4-hydroxy-6-methyl-7-oxatricyclononan-8-one

Molecular Formula: C23H28O11Molecular Weight: 480.461820 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 11

InChIKey: QQUHMASGPODSIW-RPLHGOISSA-N

• Allomatrine
Synonyms: (+)-allomatrine, CHEMBL383443, MolPort-039-052-378, ZINC4196457, 1H,5H,10H-Dipyrido[2,1-f:3',2',1'-ij][1,6]naphthyridin-10-one,dodecahydro-, (7aS,13aR,13bR,13cR)-

Molecular Formula: C15H24N2OMolecular Weight: 248.370 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZSBXGIUJOOQZMP-KYEXWDHISA-N

• alpha-Boswellic acid
IUPAC Name: (6aR,6bS,8aR,12aR)-3-hydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid | CAS Registry Number: 471-66-9

Molecular Formula: C30H48O3Molecular Weight: 456.700320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BZXULBWGROURAF-SLLOXPBESA-N

• Alpinetin
IUPAC Name: (2S)-7-hydroxy-5-methoxy-2-phenyl-2,3-dihydrochromen-4-one | CAS Registry Number: 36052-37-6
Synonyms: (-)-alpinetin, CHEBI:518574, AIDS354121, AIDS-354121, CID154279, ZINC00338037, 4H-1-Benzopyran-4-one, 2,3-dihydro-7-hydroxy-5-methoxy-2-phenyl-, (2S)-, (2S)-7-Hydroxy-5-methoxy-2-phenyl-2,3-dihydro-4H-1-benzopyran-4-one

Molecular Formula: C16H14O4Molecular Weight: 270.279960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QQQCWVDPMPFUGF-ZDUSSCGKSA-N

• Amarogentin
IUPAC Name: [(2S,3R,4S,5S,6R)-2-[[(4aS,5R,6S)-5-ethenyl-1-oxo-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl] 2,4-dihydroxy-6-(3-hydroxyphenyl)benzoate | CAS Registry Number: 21018-84-8
Synonyms: CHEBI:2622, C09767, 2-(4aS-(4aalpha,5beta,6alpha))-3,3',5-Trihydroxy-(1,1'-biphenyl)-2-carboxylate, (1,1'-Biphenyl)-2-carboxylic acid, 3,3',5-trihydroxy-, 2-ester with 5-ethenyl-6-(beta-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-1H,3H-pyrano(3,4-c)pyran-1-one, (4aS-(4aalpha,5beta,6alpha))-, (4aR)-5t-ethenyl-6c-[O(2)-(3,5,3'-trihydroxybiphenyl-2-ylcarbonyl)-beta-D-glucopyranosyloxy]-4,4ar,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one, 1H,3H-Pyrano(3,4-c)pyran-1-one, 5-ethenyl-4,4a,5,6-tetrahydro-6-((2-O-((3,3',5-trihydroxy(1,1'-biphenyl)-2-yl)carbonyl)-beta-D-glucopyranosyl)oxy)-, (4aS,5R,6S)-

Molecular Formula: C29H30O13Molecular Weight: 586.540700 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 13

InChIKey: DBOVHQOUSDWAPQ-WTONXPSSSA-N

• Amentoflavone
IUPAC Name: 8-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | CAS Registry Number: 1617-53-4
Synonyms: Didemethyl-ginkgetin, Ambap3272, 3',8''-Biapigenin, MLS000574827, MEGxp0_000924, 40584_FLUKA, AIDS000485, AIDS-000485, NSC295677, CID5281600, NSC 295677, SMR000156235, C10018, 4H-1-Benzopyran-4-one, 8-(5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-, 4H-1-Benzopyran-4-one, 8-[5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl), 79596-89-7

Molecular Formula: C30H18O10Molecular Weight: 538.457920 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 10

InChIKey: YUSWMAULDXZHPY-UHFFFAOYSA-N

• Amygdalin
IUPAC Name: (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile | CAS Registry Number: 29883-15-6
Synonyms: amygdalin, D-Amygdalin, (R)-Laenitrile, (R)-Amygdaloside, (R)-Amygdalin, STOCK1N-52529, CHEBI:17019, SMP1_000103, D(-)-Mandelonitrile-beta-D-gentiobioside, (-)-D-mandelonitrile beta-D-gentiobioside, TL8002322, C08325, D-Mandelonitrile-beta-D-glucosido-6-beta-D-glucoside, (2R)-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile

Molecular Formula: C20H27NO11Molecular Weight: 457.428480 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 12

InChIKey: XUCIJNAGGSZNQT-JHSLDZJXSA-N

• Andrographolide
IUPAC Name: (3E)-3-[2-[(1R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethylidene]-4-hydroxyoxolan-2-one | CAS Registry Number: 5508-58-7
Synonyms: Andrographis, EINECS 226-852-5, NSC 383468, C20H30O5, CID6436016, LS-70361, 2(3H)-Furanone, 3-(2-(decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl)ethylidene)dihydro-4-hydroxy-, (1R-(1-alpha(E(S*)),4a-beta,5-alpha,6-alpha,8a-alpha))-, 3-(2-(Decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylenenaphthyl)ethylidene)dihydro-4-hydroxyfuran-2(3H)-one

Molecular Formula: C20H30O5Molecular Weight: 350.449200 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: BOJKULTULYSRAS-ZJFCSBQFSA-N

• Arctigenin
IUPAC Name: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one | CAS Registry Number: 7770-78-7
Synonyms: Arctigenen, (-)-Arctigenin, Tocris-1777, A1854_SIGMA, MEGxp0_001799, Dibenzylbutyrolactone lignanolide, ACon1_000416, CHEBI:391051, AIDS002466, AIDS-002466, C21H24O6, CID64981, ZINC01615344, NCGC00025291-01, NCGC00025291-02, LS-69358, C10545, BRD-K53523901-001-01-0, 2(3H)-Furanone, 4-((3,4-dimethoxyphenyl)methyl)dihydro-3-((4-hydroxy-3-methoxyphenyl)methyl)-, (3R-trans)-, (3R,4R)-4-[(3,4-Dimethoxyphenyl)methyl]dihydro-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2(3H)-furanone

Molecular Formula: C21H24O6Molecular Weight: 372.411660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: NQWVSMVXKMHKTF-JKSUJKDBSA-N

• Arctiin
IUPAC Name: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]oxolan-2-one | CAS Registry Number: 20362-31-6
Synonyms: Arctigenin-4-glucoside, Arctiin (8CI), MEGxp0_000527, ACon1_001261, AIDS002468, NSC 315527, AIDS-002468, CID100528, NCGC00169522-01, LS-69357, 2(3H)-Furanone, 4-((3,4-dimethoxyphenyl)methyl)-3-((4-(beta-D-glucopyranosyloxy)-3-methoxyphenyl)methyl)dihydro-, (3R-trans)-, 2(3H)-Furanone, 4-((3,4-dimethoxyphenyl)methyl)-3-((4-(beta-D-glucopyranosyloxy)-3-methoxyphenyl)methyl)dihydro-, (3R-trans)- (9CI), 2(3H)-Furanone, 4-[(3,4-dimethoxyphenyl)methyl]-3-[[4-(b-D-glucopyranosyloxy)-3-methoxyphenyl]methyl]dihydro-, (3R,4R)-

Molecular Formula: C27H34O11Molecular Weight: 534.552260 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: XOJVHLIYNSOZOO-SWOBOCGESA-N

• Aristolochic acid
IUPAC Name: 8-methoxy-6-nitronaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid | CAS Registry Number: 313-67-7
Synonyms: Tardolyt, Aristolochin, Aristolochic acid I, Birthwort, Aristolochiazaeure, Aristolochic acid A, Aristolochic acid-I, ARISTOLOCHINE, Spectrum_001156, SpecPlus_000448, Spectrum2_000822, Spectrum3_001114, Spectrum4_001952, Spectrum5_000729, NCIMech_000812, CCRIS 1544, TR 1736, BSPBio_001440, BSPBio_002848, KBioGR_000160

Molecular Formula: C17H11NO7Molecular Weight: 341.271740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: BBFQZRXNYIEMAW-UHFFFAOYSA-N

• Aristolochic acid C
IUPAC Name: 10-hydroxy-6-nitronaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid | CAS Registry Number: 4849-90-5
Synonyms: Aristolochiac acid C, CID165274, Phenanthro(3,4-d)-1,3-dioxole-5-carboxylic acid, 10-hydroxy-6-nitro-, Phenanthro(3,4-d)-1,3-dioxole-5-carboxylic aicd, 10-hydroxy-6-nitro-

Molecular Formula: C16H9NO7Molecular Weight: 327.245160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: NBFGYDJKTHENDP-UHFFFAOYSA-N

• Arjunic acid
IUPAC Name: (4aS,6aS,6aS,6bR,10R,11R,12aS,14bR)-10,11-dihydroxy-12a-(hydroxymethyl)-2,2,6a,6b,9,9-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | CAS Registry Number: 31298-06-3
Synonyms: CID182035, Olean-12-en-28-oic acid, 2,3,19-trihydroxy-, (2alpha,3beta,19alpha)-, 11032-62-5

Molecular Formula: C30H48O5Molecular Weight: 488.699120 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: WDPNZZSUCIZMSX-ZKFZOLPESA-N

• Asiatic Acid
IUPAC Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | CAS Registry Number: 464-92-6
Synonyms: Asiatic acid, Ambap908, CID119034, NSC 166063, NSC-166063, LS-193512, C08617, Urs-12-en-28-oic acid, 2,3,23-trihydroxy-, (2alpha,3beta,4alpha)-, Urs-12en-28-oic acid, 2,3,23-trihydroxy-, (2alpha, 3beta, 4alpha)-, 0AS

Molecular Formula: C30H48O5Molecular Weight: 488.699120 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: JXSVIVRDWWRQRT-UYDOISQJSA-N

• Asiaticoside
IUPAC Name: [6-[[3,4-dihydroxy-6-(hydroxymethyl)-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate | CAS Registry Number: 16830-15-2
Synonyms: Asiaticosid, Emdecassol, Madecassol, Dermatologico, Centelase, Blastoestimulina, Ba 2742, CCRIS 8995, EINECS 240-851-7, NSC 166062, BRN 0078195, C48H78O19, NSC166062, LS-160852, 4-17-00-03627 (Beilstein Handbook Reference), (O-alpha-L-Rhamnopyranoxyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-O-beta-D-glucopyranosyl)-2alpha,3beta,23-trihydroxy-12-ursen-28-oat, 2alpha,3beta,23-Trihydroxy-urs-12-en-28-saeure(O-alpha-L-rhamnopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-O-beta-D-glucopyranosyl)ester, O-6-Deoxy-alpha-L-mannopyranosyl-(1.4)-O-beta-D-glucopyranosyl-(1.6)-beta-D-glucopyranosyl (2alpha,3beta,4alpha)-2,3,23-trihydroxyurs-12-en-28-oate, O-6-Desoxy-alpha-L-mannopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-O-beta-D-glucopyranosyl 2alpha,3beta,23-trihydroxy-12-ursen-28-at, Urs-12-en-28-oic acid, 2,3,23-trihydroxy-, O-6-deoxy-alpha-L-mannopyranosyl-(1-4)-O-beta-D-glucopyranosyl-(1-6)-beta-D-glucopyranosyl ester, (2alpha,3beta,4alpha)-

Molecular Formula: C48H78O19Molecular Weight: 959.121520 [g/mol]
H-Bond Donor: 12H-Bond Acceptor: 19

InChIKey: WYQVAPGDARQUBT-UHFFFAOYSA-N

• Astragaloside II
Synonyms: N1891

Molecular Formula: C43H68O16Molecular Weight: 840.990420 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 16

InChIKey: GBPDDYORNLOZID-YVEOHGMNSA-N

• Astragalus Extract
Synonyms: C41H68O14, LS-177832, 3beta,6alpha,16beta,20R,24S; astragaloside IV of astragaloside A, beta-D-Glucopyranoside, (3beta,6alpha,16beta,20R,24S)-20,24-epoxy-16,25-dihydroxy-3-(beta-D-xylopyranosyloxy)-9,19-cyclolanostan-6-yl

Molecular Formula: C41H68O14Molecular Weight: 784.970220 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 14

InChIKey: QMNWISYXSJWHRY-CSXKERSZSA-N

• Astragloside II
Synonyms: beta-D-Glucopyranoside, (3beta,6alpha,16beta,20R,24S)-3-((2-O-acetyl-beta-D-xylopyranosyl)oxy)-20,24-epoxy-16,25-dihydroxy-9,19-cyclolanostan-6-yl

Molecular Formula: C43H70O15Molecular Weight: 827.006900 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 15

InChIKey: LFJNPJBIDAQEHH-BXPIHXSGSA-N

• Atractylenolide III
IUPAC Name: (4aS,8aR,9aS)-9a-hydroxy-3,8a-dimethyl-5-methylidene-4,4a,6,7,8,9-hexahydrobenzo[f][1]benzofuran-2-one | CAS Registry Number: 73030-71-4
Synonyms: CHEBI:543914, CID155948, Naphtho(2,3-b)furan-2(4H)-one, 4a,5,6,7,8,8a,9,9a-octahydro-9a-hydroxy-3,8a-dimethyl-5-methylene-, (4aS,8aR,9aS)-

Molecular Formula: C15H20O3Molecular Weight: 248.317500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FBMORZZOJSDNRQ-GLQYFDAESA-N

• Aucubin
IUPAC Name: (2S,3R,4S,5S,6R)-2-[[(1S,4aR,5S,7aS)-5-hydroxy-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 479-98-1
Synonyms: Ambap2262, MEGxp0_001729, 55561_FLUKA, ACon1_002452, EINECS 207-540-8, AIDS031379, NSC 407293, AIDS-031379, CID91458, LMPR01020107, NSC407293, ZINC04098334, NCGC00169833-01, LS-183147, C09771, 1,4a,5,7a-Tetrahydro-5-hydroxy-7-hydroxymethylcyclopenta(c)pyran-1-yl-beta-D-glucopyranoside, (1S-(1alpha,4aalpha,5alpha,7aalpha))-1,4a,5,7a-Tetrahydro-5-hydroxy-7-(hydroxymethyl)cyclopenta(c)pyran-1-yl-beta-D-glucopyranoside, (2S,3R,4S,5S,6R)-2-((1S,4aR,5R,7aS)-5-Hydroxy-7-hydroxymethyl-1,4a,5,7a-tetrahydro-cyclopenta[c]pyran-1-yloxy)-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol

Molecular Formula: C15H22O9Molecular Weight: 346.329780 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 9

InChIKey: RJWJHRPNHPHBRN-FKVJWERZSA-N

• Avicularin
IUPAC Name: 3-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one | CAS Registry Number: 572-30-5
Synonyms: LMPK12112167, Quercetin 3-alpha-L-arabinofuranoside, CID5490064, 4H-1-Benzopyran-4-one, 3-(alpha-L-arabinofuranosyloxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-

Molecular Formula: C20H18O11Molecular Weight: 434.350320 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 11

InChIKey: BDCDNTVZSILEOY-UXYNSRGZSA-N

• Banisterine
IUPAC Name: 7-methoxy-1-methyl-9H-pyrido[3,4-b]indole | CAS Registry Number: 442-51-3
Synonyms: HARMINE, Leucoharmine, Telepathine, Yageine, Yajeine, 6-Methoxyharman, Harmin hydrochloride, Spectrum_001128, nchembio.154-comp14, SpecPlus_000611, Prestwick0_000613, Prestwick1_000613, Prestwick2_000613, Prestwick3_000613, Spectrum2_000568, Spectrum3_000906, Spectrum4_001004, Spectrum5_001914, Oprea1_596686, BSPBio_000546

Molecular Formula: C13H12N2OMolecular Weight: 212.247180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BXNJHAXVSOCGBA-UHFFFAOYSA-N

• Benzoylpaeoniflorin
Synonyms: CID170087, beta-D-Glucopyranoside, 5b-((benzoyloxy)methyl)tetrahydro-5-hydroxy-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta(cd)pentalen-1a(2H)-yl, 6-benzoate, (1aR-(1aalpha,2beta,3aalpha,5alpha,5aalpha,5balpha))-

Molecular Formula: C30H32O12Molecular Weight: 584.567880 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 12

InChIKey: KHRHASRIMPQOPU-PAMKKNMFSA-N

• Berbamine
Synonyms: BERBAMINE, Berbenine, BB_NC-1459, TNP00325, CID275182, NSC121842, NCGC00017375-01, NCGC00142548-01, NCI60_003398, C09357, Berbaman-12-ol, 6,6',7-trimethoxy-2,2'-dimethyl-, WLN: T-T66 CNT&J C1 HO1 IO- JT66 CNT&J C1 HO1 IO1 B1R DQ COR D1- B-18-J

Molecular Formula: C37H40N2O6Molecular Weight: 608.723300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: DFOCUWZXJBAUSQ-URLMMPGGSA-N

• Bergapten
IUPAC Name: 4-methoxyfuro[3,2-g]chromen-7-one | CAS Registry Number: 484-20-8
Synonyms: 5-Methoxypsoralen, bergaptene, Heraclin, Majudin, Pentaderm, Psoraderm, BERGAPTAN, Isopimpinellin, Bergapten(e), O-Methylbergaptol, 5-Methoxy psoralen, Pentaderm (TN), 5-Methoxyfuranocoumarin, 5-Mop, Spectrum_000794, Spectrum2_000534, Spectrum3_000663, Spectrum4_001478, Spectrum5_000155, 5-Methoxy-6,7-furanocoumarin

Molecular Formula: C12H8O4Molecular Weight: 216.189520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BGEBZHIAGXMEMV-UHFFFAOYSA-N

• Bergenin
IUPAC Name: (2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]isochromen-6-one | CAS Registry Number: 477-90-7
Synonyms: bergenin, Bergenin (JAN), Bergenin [JAN], MLS001213180, AIDS031337, BB_NC-1749, AIDS-031337, CID66065, NSC383465, NSC661749, ZINC04046820, 477-90-7 (ANYDROUS), SMR000542844, C09919, D01040, 3,4,4a,10b-Tetrahydro-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxypyrano(3,2-c)(2)benzopyran-6(H)-one, 3,4,8,10-Tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydropyrano[3,2-c]isochromen-6(2H)-one, 4-Methoxy-2-(tetrahydro-3,4,5-trihydroxy-6-(hydroxymethyl)pyran-2-yl)alpha-resorcylic acid gamma lactone, 5956-63-8, Pyrano[3,2-c][2]benzopyran-6(2H)-one, 3,4,4a,10b-tetrahydro-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-, (2R,3S,4S,4aR,10bS)-

Molecular Formula: C14H16O9Molecular Weight: 328.271440 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: YWJXCIXBAKGUKZ-HJJNZUOJSA-N

• Betulin
IUPAC Name: (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol | CAS Registry Number: 473-98-3
Synonyms: Betulinol, Trochol, Betuline, Betulol, Messagenin, Triterpenoid, Betulinic alcohol, Betulin, 23, Ambap4788, Prestwick3_000990, BSPBio_001059, NSC 4644, B9757_SIGMA, Lup-20(29)-ene-3beta,28-diol, BPBio1_001165, MEGxp0_001726, ACon1_000091, EINECS 207-475-5, Lup-20(30)-ene-3beta,28-diol, NSC4644

Molecular Formula: C30H50O2Molecular Weight: 442.716800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FVWJYYTZTCVBKE-ROUWMTJPSA-N

• Betulonic acid
IUPAC Name: (1R,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-5a,5b,8,8,11a-pentamethyl-9-oxo-1-prop-1-en-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-3a-carboxylic acid | CAS Registry Number: 4481-62-3
Synonyms: 3-Deoxy-3-oxo-betulinic acid, CHEBI:171232, AIDS051817, AIDS-051817, CID122844, 3-Oxolup-20(29)-en-28-oic acid, Lup-20(29)-en-28-oic acid, 3-oxo-, (1R,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-1-Isopropenyl-5a,5b,8,8,11a-pentamethyl-9-oxo-eicosahydro-cyclopenta[a]chrysene-3a-carboxylic acid, (1R,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-1-Isopropenyl-5a,5b,8,8,11a-pentamethyl-9-oxo-icosahydro-cyclopenta[a]chrysene-3a-carboxylic acid

Molecular Formula: C30H46O3Molecular Weight: 454.684440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SLJTWDNVZKIDAU-SVAFSPIFSA-N

• Bilobalide
Synonyms: Ambap2349, MLS000563448, AIDS029698, AIDS-029698, CID73581, NCGC00142501-01, NCGC00142501-02, SMR000232342, ST057155, LS-183112, 4H,5aH,9H-Furo(2,3-b)furo(3',2':2,3)cyclopenta(1,2-c)furan-2,4,7(3H,8H)-trione, 9-(1,1-dimethylethyl)-10,10a-dihydro-8,9-dihydroxy-, (5aR-(3aS*,5aalpha,8beta,8aS*,9alpha,10aalpha))-, 4H,5aH,9H-Furo[2,3-b]furo[3',2':2,3]cyclopenta[1,2-c]furan-2,4,7(3H,8H)-trione, 9-(1,1-dimethylethyl)-10,10a-dihydro-8,9-dihydroxy-,(3aS,5aR,8R,8aS,9R,10aS)-

Molecular Formula: C15H18O8Molecular Weight: 326.298620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: MOLPUWBMSBJXER-YDGSQGCISA-N

• Biochanin A
IUPAC Name: 5,7-dihydroxy-3-(4-methoxyphenyl)chromen-4-one | CAS Registry Number: 491-80-5
Synonyms: biochanin A, Biochanin, 4'-Methylgenistein, olmelin, Biochanine A, Biochanin-A, Genistein 4-methyl ether, Biochanin A (BCA), Spectrum_000195, 5,7-Dihydroxy-4'-methoxyisoflavone, Spectrum2_000047, Spectrum3_001098, Spectrum4_001927, Spectrum5_001624, Genistein 4'-methyl ether, biochanin A, 14C-labeled, CCRIS 5449, Oprea1_038096, BSPBio_002776, KBioGR_002274

Molecular Formula: C16H12O5Molecular Weight: 284.263480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: WUADCCWRTIWANL-UHFFFAOYSA-N

• Bisdemethoxycurcumin
IUPAC Name: (1E,6E)-1,7-bis(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione | CAS Registry Number: 33171-05-0
Synonyms: Curcumin III, Didemethoxycurcumin, bisdemethoxy-curcumin, Bis-demethoxycurcumin, BHCMT, Bis(4-hydroxycinnamoyl)methane, Bis(p-hydroxycinnamoyl)methane, CHEBI:269845, NSC687839, AIDS110024, AIDS-110024, CID5315472, B3347, 1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxyphenyl)-, C034786, C475935, 1,7-Bis(4-hydroxyphenyl)-1,6-heptadiene-3,5-dione, BRD-K37445107-001-01-9, (1E,6E)-1,7-Bis-(4-hydroxy-phenyl)-hepta-1,6-diene-3,5-dione, 1,6-Heptadiene-3,5-dione, 1,7-bis(4-hydroxyphenyl)-, (1E,6E)-

Molecular Formula: C19H16O4Molecular Weight: 308.327940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: PREBVFJICNPEKM-YDWXAUTNSA-N

• Boswellic acid
IUPAC Name: (3R,4R,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-3-hydroxy-4,6a,6b,8a,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picene-4-carboxylic acid | CAS Registry Number: 631-69-6
Synonyms: beta-Boswellic acid, Ambap5592, 12-Ursene-3,24-diol, MLS000697685, C30H48O3, SMR000445587, Boswellia serrata hexane extract in Hexane, LS-176290, Urs-12-en-23-oic acid, 3-hydroxy-, (3alpha,4beta)-

Molecular Formula: C30H48O3Molecular Weight: 456.700320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NBGQZFQREPIKMG-PONOSELZSA-N

• Brimonidine D-Tartrate
IUPAC Name: 5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine; (2R,3R)-2,3-dihydroxybutanedioic acid | CAS Registry Number: 70359-46-5
Synonyms: Alphagan, brimonidine, Alphagan P, Brominide tartrate, brimonidine Purite, Alphagan (TN), BRIMONIDINE TARTRATE, UNII-4S9CL2DY2H, Brimonidine tartrate (USAN), Brimonidine tartrate [USAN], C11H10BrN5.C4H6O6, AGN 190342LF, 59803-98-4 (Parent), CID54405, LS-177484, D02076, brimonidine tartrate (1:1), (S-(R*,R*))-isomer, 5-Bromo-6-(2-imidazolin-2-ylamino)quinoxaline D-tartrate (1:1), 79570-19-7, 109826-56-4

Molecular Formula: C15H16BrN5O6Molecular Weight: 442.221440 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 11

InChIKey: QZHBYNSSDLTCRG-LREBCSMRSA-N

• Brucine And Salts
Synonyms: BRUCINE, Brucina, Brucin, Indole alkaloid, l-Brucine, Dimethoxy strychnine, (-)-Brucine, Ambap7420, 2,3-Dimethoxystrychnine, 10,11-Dimethoxystrychnine, nchembio.2007.55-comp3, MLS000515808, MLS001424166, 2,3-Dimethoxystrychnidin-10-one, 399027_ALDRICH, MEGxp0_001865, ACon1_001990, AIDS002665, BB_NC-0718, AIDS-002665

Molecular Formula: C23H26N2O4Molecular Weight: 394.463540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: RRKTZKIUPZVBMF-IBTVXLQLSA-N

• Canadine
Synonyms: dl-Canadine, Xanthopuccine, Canadin, Tetrahydroberberine, Canadine dl-form, Berberine, tetrahydro-, Prestwick_186, (+)-Canadine, (+-)-Tetrahydroberberine, (.+-.)-Canadine, (-)-Tetrahydroberberine, canadine, (+-)-isomer, Prestwick0_000672, Prestwick1_000672, Prestwick2_000672, Prestwick3_000672, (d,l)-Tetrahydroberberine, CANADINE (DL-), CANADINE, (+-)-, Canadine, (.+-.)-

Molecular Formula: C20H21NO4Molecular Weight: 339.385040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: VZTUIEROBZXUFA-UHFFFAOYSA-N

• Capecitabine
IUPAC Name: pentyl N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro-2-oxopyrimidin-4-yl]carbamate | CAS Registry Number: 154361-50-9
Synonyms: Xeloda, CAPECITABINE, Capecitabine [USAN], Xeloda (TN), Capecitabine (JAN/USAN/INN), C15H22FN3O6, Ro 09-1978, DB01101, Ro-09-1978, LS-59070, N(4)-Pentyloxycarbonyl-5'-deoxy-5-fluorocytidine, Ro 09-1978/000, R-340, 5'-Deoxy-5-fluoro-N-((pentyloxy)carbonyl)cytidine, C12650, D01223, C110904, Cytidine, 5'-deoxy-5-fluoro-N-((pentyloxy)carbonyl)-, Pentyl 1-(5-deoxy-beta-D-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinecarbamate, Carbamic acid, (1-(5-deoxy-beta-D-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinyl)-, pentyl ester

Molecular Formula: C15H22FN3O6Molecular Weight: 359.350083 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: GAGWJHPBXLXJQN-UORFTKCHSA-N

• Cardamonin
IUPAC Name: (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one | CAS Registry Number: 19309-14-9
Synonyms: MLS000876992, MEGxp0_000534, ACon1_000221, CHEBI:449910, AIDS345183, AIDS-345183, CID641785, LMPK12120245, ZINC04716487, 2'4'-Dihydroxy-6'-methoxy-chalcone, NCGC00180767-01, SMR000440601, 2-Propen-1-one, 1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenyl-, (2E)-, BRD-K61559475-001-01-0, 1-(2\',4\'-Dihydroxy-6\'-methoxy-phenyl)-3-phenyl-propenone, (2E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one, (E)-1-(2,4-Dihydroxy-6-methoxyphenyl)-3-phenyl-2-propen-1-one, (E)-1-(2,4-dihydroxy-6-methoxyphenyl)-3-phenylprop-2-en-1-one, InChI=1/C16H14O4/c1-20-15-10-12(17)9-14(19)16(15)13(18)8-7-11-5-3-2-4-6-11/h2-10,17,19H,1H3/b8-7

Molecular Formula: C16H14O4Molecular Weight: 270.279960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NYSZJNUIVUBQMM-BQYQJAHWSA-N

• Carnosol
Synonyms: carnosol, CHEBI:468005, CID442009, C09069

Molecular Formula: C20H26O4Molecular Weight: 330.418040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XUSYGBPHQBWGAD-PJSUUKDQSA-N

• Carprofen
IUPAC Name: 2-(6-chloro-9H-carbazol-2-yl)propanoic acid | CAS Registry Number: 53716-49-7
Synonyms: carprofen, Imadyl, Ridamyl, Rimadyl, Carprofeno [Spanish], Rimadyl (TN), Carprofene [INN-French], Carprofenum [INN-Latin], Carprofeno [INN-Spanish], Carprofen (USAN/INN), Spectrum2_001236, Spectrum3_000939, Spectrum4_001038, Spectrum5_001802, (+-)-isomer of carprofen, CCRIS 3507, C15H12ClNO2, KBioGR_001595, Carprofen [USAN:BAN:INN], Carprofen [USAN:INN:BAN]

Molecular Formula: C15H12ClNO2Molecular Weight: 273.714280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PUXBGTOOZJQSKH-UHFFFAOYSA-N

• Casticin; Vitexicarpin
IUPAC Name: 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxychromen-4-one | CAS Registry Number: 479-91-4
Synonyms: Vitexicarpin, Casticin, LMPK12113010, CID5315263, Quercetagetin 3,6,7,4'-tetramethyl ether, 3',5-Dihydroxy-3,4',6,7-tetramethoxyflavone, 4H-1-Benzopyran-4-one, 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-

Molecular Formula: C19H18O8Molecular Weight: 374.341420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: PJQLSMYMOKWUJG-UHFFFAOYSA-N

• Catalpol
Synonyms: Catalpinoside, De(p-hydroxybenzoyl)catalposide, Catalposide, des-p-hydroxybenzoyl-, EINECS 219-324-0, CID91520, LMPR0102070007, NCGC00163523-01, LS-71485, C09773, (1AS-(1aalpha,1bbeta,2beta,5abeta,6beta,6aalpha))-1a,1b,2,5a,6,6a-hexahydro-6-hydroxy-1a-(hydroxymethyl)oxireno(4,5)cyclopenta(1,2-c)pyran-2-yl-beta-D-glucopyranoside, beta-D-Glucopyranoside, 1a,1b,2,5a,6,6a-hexahydro-6-hydroxy- 1a-(hydroxymethyl)oxireno(4,5)cyclopenta(1,2-c)pyran-2-yl, (1aS-(1a-alpha,1b-beta,2-beta,5a-beta,6-beta,6a-alpha))-, beta-D-Glucopyranoside, 1a,1b,2,5a,6,6a-hexahydro-6-hydroxy-1a-(hydroxymethyl)oxireno(4,5)cyclopenta(1,2-c)pyran-2-yl, (1aS-(1aalpha,1bbeta,2beta,5abeta,6beta,6aalpha))-

Molecular Formula: C15H22O10Molecular Weight: 362.329180 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 10

InChIKey: LHDWRKICQLTVDL-PZYDOOQISA-N

• Catharanthine
Synonyms: Catharanthin, (+)-Catharanthine, Catharanthine, (+)-, (+)-3,4-Didehydrocoronaridine, Oprea1_759080, EINECS 219-586-6, AIDS002666, AIDS-002666, LS-77564, 3,4-Didehydroibogamine-18-carboxylic acid methyl ester, Methyl (2alpha,5beta,6alpha)-3,4-didehydroibogamine-18beta-carboxylate, Methyl (2-alpha,5-beta,6-alpha,18-beta)-3,4-didehydroibogamine-18-carboxylate, Ibogamine-18-carboxylic acid, 3,4-didehydro-, methyl ester, (2-alpha,5-beta,6-alpha,18-beta)-, Ibogamine-18-carboxylic acid, 3,4-didehydro-, methyl ester, (2a,5b,6a,18b)-

Molecular Formula: C21H24N2O2Molecular Weight: 336.427460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CMKFQVZJOWHHDV-DYHNYNMBSA-N

• Chloroformamidine hydrochloride
IUPAC Name: carbamimidoyl chloride hydrochloride | CAS Registry Number: 29671-92-9
Synonyms: Chloroformamidinium chloride, EINECS 249-765-4, NSC233919, CID3084509

Molecular Formula: CH4Cl2N2Molecular Weight: 114.961860 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: FUQFHOLPJJETAP-UHFFFAOYSA-N

• Chrysophanol
IUPAC Name: 1,8-dihydroxy-3-methylanthracene-9,10-dione | CAS Registry Number: 481-74-3
Synonyms: CHRYSOPHANIC ACID, Turkey rhubarb, 3-Methylchrysazin, Crysophanic acid, Crysophanol, Chrysophansaeure, nchembio805-comp1, 1,8-Dihydroxy-3-methylanthraquinone, C.I. Natural Yellow 23, Spectrum_000792, SpecPlus_000321, Spectrum2_000043, Spectrum3_001183, Spectrum4_001477, Spectrum5_000153, 4,5-Dihydroxy-2-methylanthraquinone, CCRIS 3525, BSPBio_002825, KBioGR_002053, KBioSS_001272

Molecular Formula: C15H10O4Molecular Weight: 254.237500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LQGUBLBATBMXHT-UHFFFAOYSA-N

• Cimicifugoside
Synonyms: CID441913, C08935

Molecular Formula: C37H54O11Molecular Weight: 674.818060 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: XUJMHSCMPCZWOV-UJAIUVFWSA-N

• Cistanoside A
IUPAC Name: [(2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(4-hydroxy-3-methoxyphenyl)ethoxy]-2-[[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 93236-42-1
Synonyms: CID6450499, CID 6450499, beta-D-Glucopyranoside, 2-(4-hydroxy-3-methoxyphenyl)ethyl O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-6))-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-, Glucopyranoside, 2-(4-hydroxy-3-methoxyphenyl)ethyl O-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-6))-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-

Molecular Formula: C36H48O20Molecular Weight: 800.754320 [g/mol]
H-Bond Donor: 11H-Bond Acceptor: 20

InChIKey: LOGNFAUMIGACHZ-SCWCVTEDSA-N


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