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CHEMICAL products : Other
69401 to 69450 of 313737 results  Page: << Previous 50 Results 1380 1381 1382 1383 1384 1385 1386 1387 1388 [1389] 1390 1391 1392 1393 1394 1395 1396 1397 1398 1399 1400 >> Next 50 Results
 PRODUCT NAMECAS Registry Number 
(3beta,4alpha,16beta,21beta,22alpha)-Olean-12-ene-3,16,21,22,23,28-hexol 21-[(2E)-2-methyl-2-butenoate] (7 suppliers)
Compound Structure IUPAC Name: [(3R,4R,4aR,5S,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-4,5,10-trihydroxy-4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-3-yl] (E)-2-methylbut-2-enoate | CAS Registry Number: 1581276-63-2
Synonyms: O-Tigloylgymnemagenin, 21-O-Tigloylgymnemagenin, ZINC255287863

Molecular Formula: C35H56O7Molecular Weight: 588.826 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: ZVFCKHLBNXUAAD-DQGOMBRUSA-N

1581276-63-2
(3BETA,5A)-4-METHYLSTIGMASTA-7,24(28)-DIEN-3-OL (3 suppliers)
Compound Structure IUPAC Name: (3S,5S,9R,10S,13R,14R,17R)-4,10,13-trimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 11040-28-1
Synonyms: AC1O5V3N, EINECS 234-269-2, (3beta,5alpha)-4-Methylstigmasta-7,24(28)-dien-3-ol, (3S,5S,9R,10S,13R,14R,17R)-4,10,13-trimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Molecular Formula: C30H50OMolecular Weight: 426.717400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LPZCCMIISIBREI-GUPKAATASA-N

11040-28-1
(3BETA,5A,16BETA,20S)-20-[(2R,5S)-5-METHYLPIPERIDIN-2-YL]PREGNANE-3,16-DIOL (3 suppliers)
Compound Structure IUPAC Name: (3S,5S,8R,9S,10S,13S,14S,16S,17R)-10,13-dimethyl-17-[(1S)-1-[(2R,5S)-5-methylpiperidin-2-yl]ethyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol | CAS Registry Number: 1449-16-7
Synonyms: Dihydrotomatidine, DIHYDROTOMATODINE A, DIHYDROTOMATIDINE B, TOMATIDINE, DIHYDRO-, NSC71297, NSC29716, AIDS031945, AIDS-031945, CID232384, NSC 29716, NSC 71297, NSC226077, NCI60_039414, Pregnane-3,16-diol, 20-((2R,5S)-5-methyl-2-piperidinyl)-, (3beta,5alpha,16beta,20S)-, Pregnane-3,16-diol, 20-[(2R,5S)-5-methyl-2-piperidinyl]-, (3b,5a,16b,20S)-

Molecular Formula: C27H47NO2Molecular Weight: 417.667580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: PNCADIYJKRZFGU-HRRTYWNUSA-N

1449-16-7
(3beta,5alpha)-3-((3-(2-(Bis(2-chloroethyl)amino)phenyl)-1-oxo-2-propenyl)oxy)-17a-aza-D-homoandrostan-17-one (1 supplier)
Compound Structure IUPAC Name: [(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-2-oxo-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-1H-naphtho[2,1-f]quinolin-8-yl] (E)-3-[2-[bis(2-chloroethyl)amino]phenyl]prop-2-enoate | CAS Registry Number: 137866-25-2
Synonyms: BRN 4830753, 3-beta-Hydroxy-17a-aza-D-homo-5-alpha-androstan-17-one O-(bis(2-chloroethyl)amino)cinnamate, 17a-Aza-D-homoandrostan-17-one, 3-((3-(2-(bis(2-chloroethyl)amino)phenyl)-1-oxo-2-propenyl)oxy)-, (3-beta,5-alpha)-, AC1O60HR, LS-22671, [(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-2-oxo-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-1H-naphtho[2,1-f]quinolin-8-yl] (E)-3-[2-[bis(2-chloroethyl)amino]phenyl]prop-2-enoate

Molecular Formula: C32H44Cl2N2O3Molecular Weight: 575.609360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: XZWKOCGAAATECU-BMMFLIOGSA-N

137866-25-2
(3beta,5alpha)-3-((3-(3-(Bis(2-chloroethyl)amino)phenyl)-1-oxo-2-propenyl)oxy)-17a-aza-D-homoandrostan-17-one (1 supplier)
Compound Structure IUPAC Name: [(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-2-oxo-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-1H-naphtho[2,1-f]quinolin-8-yl] (E)-3-[3-[bis(2-chloroethyl)amino]phenyl]prop-2-enoate | CAS Registry Number: 137866-26-3
Synonyms: BRN 4830097, 17a-Aza-D-homoandrostan-17-one, 3-((3-(3-(bis(2-chloroethyl)amino)phenyl)-1-oxo-2-propenyl)oxy)-, (3-beta,5-alpha)-, 3beta-Hydroxy-13alpha-amino-13,17-seco-5alpha-androstan-17-oic-13,17-lactam-m-N,N-bis(2-chloroethyl)aminocinnamate, AC1O5UZ2, CCRIS 8276, LS-22672, [(4aS,4bR,6aS,8S,10aS,10bS,12aS)-10a,12a-dimethyl-2-oxo-3,4,4a,4b,5,6,6a,7,8,9,10,10b,11,12-tetradecahydro-1H-naphtho[2,1-f]quinolin-8-yl] (E)-3-[3-[bis(2-chloroethyl)amino]phenyl]prop-2-enoate

Molecular Formula: C32H44Cl2N2O3Molecular Weight: 575.609360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: MJJQETZDTOSLSA-XMILLTGRSA-N

137866-26-3
(3beta,5alpha,11alpha,12beta,14beta,17alpha,)-12-(Acetyloxy)-3-[[2,6-dideoxy-4-O-(6-deoxy-3-O-methyl-beta-D-allopyranosyl)-3-O-methyl-beta-D-arabino-hexopyranosyl]oxy]-8,14-epoxy-11-(2-methyl-1-oxopropoxy)-pregnan-20-one (9 suppliers)
Compound Structure IUPAC Name: [(1~{S},3~{R},6~{R},7~{S},8~{S},9~{S},10~{S},11~{S},14~{S},16~{S})-6-acetyl-8-acetyloxy-14-[(2~{R},4~{R},5~{R},6~{R})-5-[(2~{S},3~{R},4~{R},5~{R},6~{R})-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-7,11-dimethyl-2-oxapentacyclo[8.8.0.0^{1,3}.0^{3,7}.0^{11,16}]octadecan-9-yl] 2-methylpropanoate | CAS Registry Number: 1260252-18-3
Synonyms: DAXMBTMYJCYTRG-IRCPNMLKSA-N, MolPort-044-754-078, ZINC299817453, (17R)-3beta-[[3-O-Methyl-4-O-(3-O-methyl-6-deoxy-beta-D-allopyranosyl)-2,6-dideoxy-beta-D-arabino-hexopyranosyl]oxy]-20-oxo-8,14beta-epoxy-5alpha-pregnane-11alpha,12beta-diol 11-isobutyrate 12-acetate, 3-O-beta-Allopyranosyl-(1->4)-beta-oleandropyranosyl-11-O-isobutyryl-12-O-acetyltenacigenin B, TenacigeninB,3-O-beta-Allopyranosyl-(1-->4)-beta-oleandropyranosyl-11-O-isobutyryl-12-O-acetyl-

Molecular Formula: C41H64O14Molecular Weight: 780.949 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 14

InChIKey: DAXMBTMYJCYTRG-IRCPNMLKSA-N

1260252-18-3
(3beta,5alpha,17alpha)-19-NORPREGNANE-3,17-DIOL, (7 suppliers)
Compound Structure IUPAC Name: (5S,8R,9R,10S,13S,14S,17S)-17-ethyl-13-methyl-2,3,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol | CAS Registry Number: 7253-95-4
Synonyms: 17|A-Ethyl-5|A-estrane-3|A,17|A-diol, 19-Nor-5|A,17|A-pregnane-3|A,17-diol, (3|A,5|A,17|A)-19-Norpregnane-3,17-diol, NSC 65407

Molecular Formula: C20H34O2Molecular Weight: 306.482760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GUBNWXDDDXQJOQ-POIZRLADSA-N

7253-95-4
(3beta,5alpha,6alpha,16beta)-8,14-Didehydrocevane-3,6,16,20-tetrol (3 suppliers)
Compound Structure IUPAC Name: (1S,2S,6S,9S,10S,11R,12S,17S,18S,20S,23R,24R)-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacos-14-ene-10,12,17,20-tetrol | CAS Registry Number: 126594-75-0
Synonyms: Benzo[7,8]fluoreno[2,1-b]quinolizine, cevane-3,6,16,20-tetrol deriv.

Molecular Formula: C27H43NO4Molecular Weight: 445.600 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: XRMIUPIDCAASQZ-VSWWUBQKSA-N

126594-75-0
(3beta,5beta)-14-Hydroxy-3-(2,3,4,6-tetraacetyl-beta-D-glucopyranosyloxy)card-20(22)-enolide (1 supplier)
Compound Structure IUPAC Name: [(3R,6R)-3,4,5-triacetyloxy-6-[[(3S,5R,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxan-2-yl]methyl acetate | CAS Registry Number: 35068-75-8
Synonyms: Digitoxigenin-beta-tetraacetyl-d-glucoside, Card-20(22)-enolide, 14-hydroxy-3-((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)oxy)-, (3-beta,5-beta)-, AC1L1WW6, LS-52480, [(3R,6R)-3,4,5-triacetyloxy-6-[[(3S,5R,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxan-2-yl]methyl acetate

Molecular Formula: C37H52O13Molecular Weight: 704.800980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 13

InChIKey: JVPQSPMBCSUIQA-BHICCFOUSA-N

35068-75-8
(3BETA,5BETA)-3-[(2,6-DIDEOXY-SS-D-RIBO-HEXOPYRANOSYL)OXY]-5,14,19-TRIHYDROXYCARD-20(22)-ENOLIDE (4 suppliers)
Compound Structure IUPAC Name: 3-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-5,14-dihydroxy-10-(hydroxymethyl)-13-methylspiro[1,2,3,4,6,7,8,9,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene-17,3'-2H-pyran]-6'-one | CAS Registry Number: 18695-02-8
Synonyms: EINECS 242-508-7, CID86779, (3beta,5beta)-3-((2,6-Dideoxy-beta-D-ribo-hexopyranosyl)oxy)-5,14,19-trihydroxycard-20(22)-enolide

Molecular Formula: C29H44O9Molecular Weight: 536.654260 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: VSTMPNVFJSGMIJ-UHFFFAOYSA-N

18695-02-8
(3BETA,5BETA)-3-[(6-DEOXY-4-O-SS-D-GLUCOPYRANOSYL-A-L-MANNOPYRANOSYL)OXY]-5,14-DIHYDROXY-19-OXOCARD-20(22)-ENOLIDE (1 supplier)
Compound Structure IUPAC Name: (3S,5S,8R,9S,10S,13R,14S,17R)-3-[(2R,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde | CAS Registry Number: 13473-51-3
Synonyms: Convalloside, Bogoroside, Convallosid [German], EINECS 236-749-7, Convallosid, (3beta,5beta)-3-((6-Deoxy-4-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy)-5,14-dihydroxy-19-oxocard-20(22)-enolide, Card-20(22)-enolide, 3-((6-deoxy-4-O-beta-D-glucopyranosyl-alpha-L-mannopyranosyl)oxy)-5,14-dihydroxy-19-oxo-, (3beta,5alpha)-, AC1L3FR2, CHEMBL1169677, ZINC85902293, LS-54795, C19986, (3S,5S,8R,9S,10S,13R,14S,17R)-3-[(2R,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde

Molecular Formula: C35H52O15Molecular Weight: 712.786 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 15

InChIKey: CAYUJEAJKPLCAV-TZOZDROWSA-N

13473-51-3
(3beta,5beta,16beta)-3-((2,6-Dideoxy-beta-D-ribo-hexopyranosyl)oxy)-14,16-dihydroxycard-20(22)-enolide 16-formate (0 suppliers)
Compound Structure IUPAC Name: [(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] formate | CAS Registry Number: 53735-73-2
Synonyms: Lanadoxin, EINECS 258-734-4, Gitaloxigenin-mono-digitoxosid [German], BRN 0070815, Card-20(22)-enolide, 3-((2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-16-(formyloxy)-14-hydroxy-, (3-beta,5-beta,16-beta)-, Gitaloxigenin-mono-digitoxosid, AC1L24M7, LS-52375, 4-18-00-02466 (Beilstein Handbook Reference), [(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] formate, 11014-58-7

Molecular Formula: C30H44O9Molecular Weight: 548.664960 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: IOXIBFLACIBMNF-RBRVDKDNSA-N

53735-73-2
(3BETA,5BETA,16BETA)-3-[(2,6-DIDEOXY-SS-D-RIBO-HEXOPYRANOSYL)OXY]-14,16-DIHYDROXYCARD-20(22)-ENOLIDE 16-ACETATE (3 suppliers)
Compound Structure IUPAC Name: [3-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] acetate | CAS Registry Number: 53735-71-0
Synonyms: EINECS 258-733-9, CID103822, (3beta,5beta,16beta)-3-((2,6-Dideoxy-beta-D-ribo-hexopyranosyl)oxy)-14,16-dihydroxycard-20(22)-enolide 16-acetate

Molecular Formula: C31H46O9Molecular Weight: 562.691540 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: QWTDCDSWAVIWER-UHFFFAOYSA-N

53735-71-0
(3beta,5beta,17alpha)-19-NORPREGNANE-3,17-DIOL, (6 suppliers)
Compound Structure IUPAC Name: (3S,5R,8R,9R,10S,13S,14S,17S)-17-ethyl-13-methyl-2,3,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol | CAS Registry Number: 31658-51-2
Synonyms: 17|A-Ethyl-5|A-estrane-3|A,17|A-diol, 19-Nor-5|A,17|A-pregnane-3|A,17-diol, (3|A,5|A,17|A)-19-Norpregnane-3,17-diol

Molecular Formula: C20H34O2Molecular Weight: 306.482760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GUBNWXDDDXQJOQ-GZZXEUMKSA-N

31658-51-2
(3beta,6alpha,12beta,24R)-20,24-Epoxydammarane-3,6,12,25-tetrol (6 suppliers)
Compound Structure IUPAC Name: (3S,5R,6S,8R,9R,10R,12R,13R,14R,17S)-17-[(2S,5R)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,6,12-triol | CAS Registry Number: 69926-31-4
Synonyms: 20(S),24(R)-Ocotillol, (20S)-Protopanaxatriol oxide I

Molecular Formula: C30H52O5Molecular Weight: 492.730880 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: XIGBHUXQOPWGDK-HTGHARJWSA-N

69926-31-4
(3BETA,6E)-9,10-SECOCHOLESTA-5(10),6,8-TRIEN-3-OL (12 suppliers)
Compound Structure IUPAC Name: 3-[(E)-2-[7a-methyl-1-(6-methylheptan-2-yl)-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-ol | CAS Registry Number: 17592-07-3
Synonyms: Previtamin D(3), EINECS 241-561-3, CID6178113, (3beta,6E)-9,10-Secocholesta-5(10),6,8-trien-3-ol

Molecular Formula: C27H44OMolecular Weight: 384.637660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YUGCAAVRZWBXEQ-OUKQBFOZSA-N

17592-07-3
(3beta,7alpha,15alpha)-3,7,15-Trihydroxy-androst-5-en-17-one (13 suppliers)
Compound Structure IUPAC Name: (3S,7S,8R,9S,10R,13S,14S,15S)-3,7,15-trihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one | CAS Registry Number: 2963-69-1
Synonyms: 3b,7a,15a-Trihydroxyandrost-5-en-17-one, SureCN855786, CTK4G3590, MolPort-004-786-160, AKOS016000585, AG-E-96606, AK118972, KB-234749, FT-0654908, Androst-5-en-17-one,3,7,15-trihydroxy-, (3b,7a,15a)-, Androst-5-en-17-one,3b,7a,15a-trihydroxy- (7CI,8CI);3b,7a,15a-Trihydroxyandrost-5-en-17-one;

Molecular Formula: C19H28O4Molecular Weight: 320.423220 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: FTEHGIIZAGEILF-NSSDSGNWSA-N

2963-69-1
(3beta,9beta,10alpha)-3-HYDROXY-PREGNA-5,7-DIEN-20-ONE, (5 suppliers)
Compound Structure IUPAC Name: 1-[(3S,9S,10S,13S,14R,17S)-3-hydroxy-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone | CAS Registry Number: 1819-14-3
Synonyms: FT-0670020, 3|A-Hydroxy-9|A,10|A-pregna-5,7-dien-20-one, (3|A,9|A,10|A)-3-Hydroxy-pregna-5,7-dien-20-one

Molecular Formula: C21H30O2Molecular Weight: 314.461700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QTVNPWWLYMFLEI-BFNCPCAZSA-N

1819-14-3
(3BR,3CS,5AS,6R,8AS,8BS,10AR)-N-(TERT-BUTYL)-3B,5A-DIMETHYL-2-OXOHEXADECAHYDRO-1H-INDENO[5,4-F]OXIRENO[2,3-C]QUINOLINE-6-CARBOXAMIDE (1 supplier)
(3Br,4aR)-ethyl 3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-3-carboxylate (1 supplier)2412008-81-0
(3br,4r,5ar,10ar,10br,12as)-1-(furan-3-yl)-4-hydroxy-3b,6,6,10a,12a-pentamethyl-1,2,4,5,5a,10b,11,12-octahydroindeno[5,4-g][2]benzoxepin-8-one (2 suppliers)
Compound Structure IUPAC Name: (3bR,4R,5aR,10aR,10bR,12aS)-1-(furan-3-yl)-4-hydroxy-3b,6,6,10a,12a-pentamethyl-1,2,4,5,5a,10b,11,12-octahydroindeno[5,4-g][2]benzoxepin-8-one | CAS Registry Number: 79203-53-5
Synonyms: NSC351319, 7-Desacetylproceranone, AC1L7JW1, PROCERANONE, 7-DESACETYL-, NSC-351319, (3bR,4R,5aR,10aR,10bR,12aS)-1-(furan-3-yl)-4-hydroxy-3b,6,6,10a,12a-pentamethyl-1,2,4,5,5a,10b,11,12-octahydroindeno[5,4-g][2]benzoxepin-8-one

Molecular Formula: C26H34O4Molecular Weight: 410.545760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZPDGIAXQQRWSBB-IQNVCQIZSA-N

79203-53-5
(3bR,9bS)-6-Methoxy-9b-Methyl-3b,4,5,9b,10,11-hexahydrophenanthro[1,2-c]furan-1(3H)-one (1 supplier)
Compound Structure IUPAC Name: (9bS)-6-methoxy-9b-methyl-3,3b,4,5,10,11-hexahydronaphtho[2,1-e][2]benzofuran-1-one | CAS Registry Number: 1209485-40-4
Synonyms: (3bR,9bS)-6-Methoxy-9b-methyl-3b,4,5,9b,10,11-hexahydrophenanthro[1,2-c]furan-1(3H)-one

Molecular Formula: C18H20O3Molecular Weight: 284.300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: KGTIKCFPVQYYJL-KPMSDPLLSA-N

1209485-40-4
(3br,9bs)-8-hydroxy-6-methoxy-9b-methyl-7-(propan-2-yl)-3b,4,5,9b,10,11-hexahydrophenanthro[1,2-c]furan-1(3h)-one (0 suppliers)
Compound Structure IUPAC Name: 8-hydroxy-6-methoxy-9b-methyl-7-propan-2-yl-3,3b,4,5,10,11-hexahydronaphtho[2,1-e][2]benzofuran-1-one | CAS Registry Number: 104331-86-4
Synonyms: ACMC-20dhnb, AC1NSX36, Phenanthro[1,2-c]furan-1(3H)-one,3b,4,5,9b,10,11-hexahydro-8-hydroxy-6-methoxy-9b-methyl-7-(1-methylethyl)-,(3bR,9bS)- (9CI), 8-hydroxy-6-methoxy-9b-methyl-7-propan-2-yl-3,3b,4,5,10,11-hexahydronaphtho[2,1-e][2]benzofuran-1-one

Molecular Formula: C21H26O4Molecular Weight: 342.428740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: TYSYVCOVDLVELY-UHFFFAOYSA-N

104331-86-4
(3BR,9BS)-9-HYDROXY-6-METHOXY-9B-METHYL-7-(PROPAN-2-YL)-3B,4,5,9B,10,11-HEXAHYDROPHENANTHRO[1,2-C]FURAN-1(3H)-ONE (0 suppliers)
Compound Structure IUPAC Name: (1R,2S,3S,4R)-1,2,3,4-tetrahydrobenzo[a]anthracene-1,2,3,4-tetrol | CAS Registry Number: 86513-61-3
Synonyms: AC1L4L0Z, CTK5F6879, CA005181, (1r,2s,3s,4r)-1,2,3,4-tetrahydrotetraphene-1,2,3,4-tetrol, (1R,2S,3S,4R)-1,2,3,4-tetrahydrobenzo[a]anthracene-1,2,3,4-tetrol

Molecular Formula: C18H16O4Molecular Weight: 296.322 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: OBPNVPPKXVIGQS-BDXSIMOUSA-N

86513-61-3
(3bS)-6?-Acetoxy-7,7,10a?-trimethyl-3b?,5a?,6,6a?,7,8,9,10,10a,10b?,10c?,11-dodecahydro-4H-phenanthro[3,2-b:10,1-b'c']difuran-4-one (1 supplier)
Compound Structure Synonyms: 6-Acetoxy-17,7-vouacapanolide

Molecular Formula: C22H28O5Molecular Weight: 372.461 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: VBQFNMXWLYRLKA-DSAVUWMGSA-N

40776-66-7
(3BS,4aR)-3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-b]pyrrole (3 suppliers)
Compound Structure IUPAC Name: (2S,4R)-3,3,9-trimethyl-7-azatricyclo[4.3.0.02,4]nona-1(6),8-diene | CAS Registry Number: 872117-38-9
Synonyms: (3BS,4AR)-3,4,4-TRIMETHYL-3B,4,4A,5-TETRAHYDRO-1H-CYCLOPROPA[3,4]CYCLOPENTA[1,2-B]PYRROLE, SCHEMBL6508982, MolPort-035-776-765

Molecular Formula: C11H15NMolecular Weight: 161.240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: CJDBNAPQUNCFMI-GMSGAONNSA-N

872117-38-9
(3BS,4aR)-3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole (2 suppliers)
Compound Structure Synonyms: (3BS,4AR)-3,4,4-TRIMETHYL-3B,4,4A,5-TETRAHYDRO-1H-CYCLOPROPA[3,4]CYCLOPENTA[1,2-C]PYRAZOLE, AC1LG7M1, Cambridge id 5618302, MolPort-002-510-473, ZINC4693078, AKOS027332836

Molecular Formula: C10H14N2Molecular Weight: 162.236 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BXPXTOORXLMQOD-HZGVNTEJSA-N

156145-76-5
(3bS,4aR)-3,4,4-Trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-1-carbothioic O-acid (3 suppliers)
Compound Structure Synonyms: MolPort-028-912-665, AKOS024463814, AK161403, AJ-133947, ST24034452

Molecular Formula: C11H14N2OSMolecular Weight: 222.306660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RQQLKYZMMLKYHE-HZGVNTEJSA-N

1451390-45-6
(3BS,4aR)-3-(trifluoromethyl)-1,3b,4,4a-tetrahydro-5H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazol-5-one (1 supplier)2375019-86-4
(3BS,4aR)-ethyl 3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-b]pyrrole-2-carboxylate (2 suppliers)
Compound Structure IUPAC Name: ethyl (2R,4S)-3,3,9-trimethyl-7-azatricyclo[4.3.0.02,4]nona-1(6),8-diene-8-carboxylate | CAS Registry Number: 872117-39-0

Molecular Formula: C14H19NO2Molecular Weight: 233.311 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UKTOIIDOXOKKGI-KWQFWETISA-N

872117-39-0
(3BS,4aS)-3-(trifluoromethyl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole (1 supplier)2375019-88-6
(3bs,5as,6s,8as,8bs)-5a-methyl-4,5,5a,6,7,8,8a,8b,9,10-decahydro-3bh-cyclopenta[5,6]naphtho[2,1-b]thiophene-6-ol (1 supplier)
Compound Structure IUPAC Name: (3bS,5aS,6S,8aS,8bS)-5a-methyl-3b,4,5,6,7,8,8a,8b,9,10-decahydroindeno[5,4-e][1]benzothiol-6-ol | CAS Registry Number: 71995-93-2
Synonyms: AG-J-77985, AC1L4TJI, AC1Q59WK, CTK5D5349, KST-1A8965, AR-1A4119, A-Nor-3-thiaestra-1,5(10)-dien-17beta-ol, A-Nor-3-thiaestra-1,5(10)-dien-17-ol, (17beta)-(+-)-, (3bS,5aS,6S,8aS,8bS)-5a-methyl-3b,4,5,6,7,8,8a,8b,9,10-decahydroindeno[5,4-e][1]benzothiol-6-ol

Molecular Formula: C16H22OSMolecular Weight: 262.410280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JWZLPBSNBPYKOV-AYCVOAMHSA-N

71995-93-2
(3E)-?-(2-Chlorophenyl)-3-(2-ethoxy-2-oxoethylidene)-4-hydroxy-1-piperidineacetic Acid Methyl Ester(Mixture of Diastereomers) (6 suppliers)
Compound Structure IUPAC Name: methyl 2-(2-chlorophenyl)-2-[(3E)-3-(2-ethoxy-2-oxoethylidene)-4-hydroxypiperidin-1-yl]acetate | CAS Registry Number: 204205-19-6
Synonyms: SureCN6575562, (3E)-|A-(2-Chlorophenyl)-3-(2-ethoxy-2-oxoethylidene)-4-hydroxy-1-piperidineacetic Acid Methyl Ester(Mixture of Diastereomers)

Molecular Formula: C18H22ClNO5Molecular Weight: 367.823980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: WAFXXZZOSCVLEO-ZRDIBKRKSA-N

204205-19-6
(3e)-1'-butylsulfanyl-3-(butylsulfanylmethylidene)-7,7'-dimethoxyspiro[1,2-dihydronaphthalene-4,3'-2,4,9,10-tetrahydro-1h-phenanthrene] (1 supplier)
Compound Structure IUPAC Name: (3E)-1'-butylsulfanyl-3-(butylsulfanylmethylidene)-7,7'-dimethoxyspiro[1,2-dihydronaphthalene-4,3'-2,4,9,10-tetrahydro-1H-phenanthrene] | CAS Registry Number: 66100-76-3
Synonyms: NSC308006, AC1NTMKZ, NSC-308006, (3E)-1'-butylsulfanyl-3-(butylsulfanylmethylidene)-7,7'-dimethoxyspiro[1,2-dihydronaphthalene-4,3'-2,4,9,10-tetrahydro-1H-phenanthrene]

Molecular Formula: C34H44O2S2Molecular Weight: 548.841960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XAMWXSFDJFGEBK-WNAAXNPUSA-N

66100-76-3
(3E)-1,1,1-Trifluoro-4-(1H-indol-3-yl)but-3-en-2-ol (4 suppliers)
Compound Structure IUPAC Name: (E)-1,1,1-trifluoro-4-(1H-indol-3-yl)but-3-en-2-ol | CAS Registry Number: 478040-85-6
Synonyms: (E)-1,1,1-trifluoro-4-(1H-indol-3-yl)-3-buten-2-ol, (3E)-1,1,1-trifluoro-4-(1H-indol-3-yl)but-3-en-2-ol, (E)-1,1,1-trifluoro-4-(1H-indol-3-yl)but-3-en-2-ol, MFCD02571916, AKOS015992642, 3R-0704

Molecular Formula: C12H10F3NOMolecular Weight: 241.210 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YGQJAOQHDNLYFN-AATRIKPKSA-N

478040-85-6
(3E)-1,1,1-Trifluoro-4-(3-methylphenyl)but-3-en-2-one (3 suppliers)
Compound Structure IUPAC Name: (E)-1,1,1-trifluoro-4-(3-methylphenyl)but-3-en-2-one | CAS Registry Number: 306769-09-5
Synonyms: (3E)-1,1,1-trifluoro-4-(3-methylphenyl)but-3-en-2-one, BBL021864, KM4384, MFCD09832461, STK894581, ZINC12404865, 3-Methylstyryl(trifluoromethyl) ketone, AKOS005144513, (E)-1,1,1-trifluoro-4-(3-methylphenyl)-3-buten-2-one, (E)-1,1,1-Trifluoro-4-(3-methylphenyl)-3-butene-2-one

Molecular Formula: C11H9F3OMolecular Weight: 214.180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: UEAAAIFZSJPHJC-AATRIKPKSA-N

306769-09-5
(3E)-1,1,1-Trifluoro-4-(4-phenylpiperazin-1-yl)but-3-en-2-one (5 suppliers)
Compound Structure IUPAC Name: (E)-1,1,1-trifluoro-4-(4-phenylpiperazin-1-yl)but-3-en-2-one | CAS Registry Number: 478047-04-0
Synonyms: AC1NYS56, 1,1,1-trifluoro-4-(4-phenylpiperazin-1-yl)but-3-en-2-one, ZINC4052499, ZX-RL001012, AKOS005093349, PC300679, 4R-0601, (3E)-1,1,1-trifluoro-4-(4-phenylpiperazin-1-yl)but-3-en-2-one, (E)-1,1,1-trifluoro-4-(4-phenylpiperazin-1-yl)but-3-en-2-one

Molecular Formula: C14H15F3N2OMolecular Weight: 284.282 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: WGTSWLHDBUPUBO-VOTSOKGWSA-N

478047-04-0
(3E)-1,1,1-Trifluoro-4-(phenylamino)but-3-en-2-one (4 suppliers)
Compound Structure IUPAC Name: (~{E})-4-anilino-1,1,1-trifluorobut-3-en-2-one | CAS Registry Number: 134219-71-9
Synonyms: 3-Oxo-1-(phenylamino)-4,4,4-trifluorobut-1-ene, (3E)-1,1,1-trifluoro-4-(phenylamino)but-3-en-2-one, 1,1,1-trifluoro-4-(phenylamino)but-3-en-2-one, AC1NVV2O, MLS001007276, CHEMBL1465374, MolPort-001-775-692, MolPort-039-015-376, HMS1786N11, HMS2724N05, ZINC2570219, ZX-AP007988, PC4900, SBB095081, AKOS001029060, SMR000352542, 1,1,1-Trifluoro-4-anilino-3-butene-2-one, (E)-4-anilino-1,1,1-trifluorobut-3-en-2-one, 1-trifluoromethyl-3-(phenylamino)prop-2-en-1-one, 5R-0603

Molecular Formula: C10H8F3NOMolecular Weight: 215.175 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: PTCXQMALTDIQMW-VOTSOKGWSA-N

134219-71-9
(3E)-1,1,1-Trifluoro-4-(phenylsulfonyl)-3-butene-2,2-diol (1 supplier)329915-01-7
(3E)-1,1,1-Trifluoro-4-[(2-oxo-2-phenylethyl)amino]pent-3-en-2-one (3 suppliers)
Compound Structure IUPAC Name: (E)-1,1,1-trifluoro-4-(phenacylamino)pent-3-en-2-one | CAS Registry Number: 339010-40-1
Synonyms: (3E)-1,1,1-trifluoro-4-[(2-oxo-2-phenylethyl)amino]pent-3-en-2-one, AKOS005097851, ZINC100095390, 7G-010

Molecular Formula: C13H12F3NO2Molecular Weight: 271.230 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: IFFBNQVEORJUEJ-VQHVLOKHSA-N

339010-40-1
(3E)-1,1,1-Trifluoro-4-[(pyridin-3-yl)amino]but-3-en-2-one (3 suppliers)
Compound Structure IUPAC Name: (E)-1,1,1-trifluoro-4-(pyridin-3-ylamino)but-3-en-2-one | CAS Registry Number: 428842-24-4
Synonyms: (E)-1,1,1-trifluoro-4-(3-pyridinylamino)-3-buten-2-one, (E)-1,1,1-trifluoro-4-(pyridin-3-ylamino)but-3-en-2-one, (3E)-1,1,1-trifluoro-4-[(pyridin-3-yl)amino]but-3-en-2-one, ZINC3195122, MFCD01972158, AKOS001030463, 3R-0662

Molecular Formula: C9H7F3N2OMolecular Weight: 216.160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: LKKNTTDSIMZFIG-HWKANZROSA-N

428842-24-4
(3E)-1,1,1-Trifluoro-4-[4-(pyrimidin-2-yl)piperazin-1-yl]but-3-en-2-one (3 suppliers)
Compound Structure IUPAC Name: (E)-1,1,1-trifluoro-4-(4-pyrimidin-2-ylpiperazin-1-yl)but-3-en-2-one | CAS Registry Number: 691858-24-9
Synonyms: (E)-1,1,1-trifluoro-4-[4-(2-pyrimidinyl)piperazino]-3-buten-2-one, (3E)-1,1,1-trifluoro-4-[4-(pyrimidin-2-yl)piperazin-1-yl]but-3-en-2-one, (E)-1,1,1-trifluoro-4-(4-pyrimidin-2-ylpiperazin-1-yl)but-3-en-2-one, ZINC4014710, MFCD03102671, AKOS005076301, 10R-1066

Molecular Formula: C12H13F3N4OMolecular Weight: 286.250 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 8

InChIKey: NBDLKLHBYLZKDJ-GORDUTHDSA-N

691858-24-9
(3E)-1,1,1-Trifluoro-4-{[2-(1H-indol-3-yl)ethyl]amino}but-3-en-2-one (3 suppliers)
Compound Structure IUPAC Name: (E)-1,1,1-trifluoro-4-[2-(1H-indol-3-yl)ethylamino]but-3-en-2-one | CAS Registry Number: 478040-78-7
Synonyms: (3E)-1,1,1-trifluoro-4-{[2-(1H-indol-3-yl)ethyl]amino}but-3-en-2-one, (E)-1,1,1-trifluoro-4-[2-(1H-indol-3-yl)ethylamino]but-3-en-2-one, AKOS005089220, ZINC100405259, 3R-0687, (E)-1,1,1-trifluoro-4-{[2-(1H-indol-3-yl)ethyl]amino}-3-buten-2-one

Molecular Formula: C14H13F3N2OMolecular Weight: 282.260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: FKGVMUPVWRQQDT-SOFGYWHQSA-N

478040-78-7
(3E)-1,1,1-Trifluoro-4-{[2-(trifluoromethoxy)phenyl]amino}but-3-en-2-one (3 suppliers)
Compound Structure IUPAC Name: 1,1,1-trifluoro-4-[2-(trifluoromethoxy)anilino]but-3-en-2-one | CAS Registry Number: 1164558-76-2
Synonyms: (E)-1,1,1-trifluoro-4-[2-(trifluoromethoxy)anilino]-3-buten-2-one, AC1NF7M1, KS-00001VTP, AKOS030244827, 1,1,1-trifluoro-4-[2-(trifluoromethoxy)anilino]but-3-en-2-one

Molecular Formula: C11H7F6NO2Molecular Weight: 299.172 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: QBSIIZGXKKBGRB-UHFFFAOYSA-N

1164558-76-2
(3E)-1,1,1-Trifluoro-4-{[4-(trifluoromethoxy)phenyl]amino}but-3-en-2-one (3 suppliers)
Compound Structure IUPAC Name: 1,1,1-trifluoro-4-[4-(trifluoromethoxy)anilino]but-3-en-2-one | CAS Registry Number: 1164457-71-9
Synonyms: (E)-1,1,1-trifluoro-4-[4-(trifluoromethoxy)anilino]-3-buten-2-one, AC1MWFUE, KS-00001VTQ, AKOS030244828, MCULE-6377527607, 1,1,1-trifluoro-4-[4-(trifluoromethoxy)anilino]but-3-en-2-one

Molecular Formula: C11H7F6NO2Molecular Weight: 299.172 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: ZKCOFNGKINQHNL-UHFFFAOYSA-N

1164457-71-9
(3E)-1,1,1-Trifluoro-4-{[4-(trifluoromethyl)phenyl]amino}pent-3-en-2-one (3 suppliers)
Compound Structure IUPAC Name: (~{E})-1,1,1-trifluoro-4-[4-(trifluoromethyl)anilino]pent-3-en-2-one | CAS Registry Number: 1164537-19-2
Synonyms: 1,1,1-trifluoro-4-[4-(trifluoromethyl)anilino]-3-penten-2-one, AC1O0X6T, CHEMBL3211229, MolPort-002-859-924, HMS2163K16, ZINC13121701, AKOS005083260, 1N-733, (3E)-1,1,1-trifluoro-4-{[4-(trifluoromethyl)phenyl]amino}pent-3-en-2-one

Molecular Formula: C12H9F6NOMolecular Weight: 297.200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: OOPSSEBRWAAECV-VOTSOKGWSA-N

1164537-19-2
(3e)-1,1,4-trichlorobuta-1,3-diene (1 supplier)
Compound Structure IUPAC Name: (3E)-1,1,4-trichlorobuta-1,3-diene | CAS Registry Number: 83682-46-6
Synonyms: 1-Butyne, 1,4,4-trichloro-, AC1O5JRF, SCHEMBL3263787, (3E)-1,1,4-trichlorobuta-1,3-diene

Molecular Formula: C4H3Cl3Molecular Weight: 157.425620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PUFQCNYOVQTFSS-HNQUOIGGSA-N

83682-46-6
(3E)-1,1-Difluoro-4-methoxypent-3-en-2-one (5 suppliers)
Compound Structure IUPAC Name: (E)-1,1-difluoro-4-methoxypent-3-en-2-one | CAS Registry Number: 2060523-80-8
Synonyms: ZINC584880021

Molecular Formula: C6H8F2O2Molecular Weight: 150.120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JUUCOBAYROZKKJ-ONEGZZNKSA-N

2060523-80-8
(3e)-1,1-dimethyl-3-(3,4,5-trimethyl-1,3-thiazol-2-ylidene)thiourea (1 supplier)
Compound Structure IUPAC Name: (3E)-1,1-dimethyl-3-(3,4,5-trimethyl-1,3-thiazol-2-ylidene)thiourea | CAS Registry Number: 75373-93-2
Synonyms: THIOUREA, DIMETHYL(3,4,5-TRIMETHYL-2(3H)-THIAZOLYLIDENE)

Molecular Formula: C9H15N3S2Molecular Weight: 229.365500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HPWMEACLKXKNDU-MDZDMXLPSA-N

75373-93-2
(3E)-1,3-Dihydro-3-(1H-imidazol-4-ylmethylene)-2H-indol-2-one (1 supplier)
Compound Structure IUPAC Name: 3-(1H-imidazol-5-ylmethylidene)-1H-indol-2-one | CAS Registry Number: 372164-71-1
Synonyms: Angiogenesis Inhibitor, IN1412, Tripolin B, AC1MDJI3, CTK8F7773, MCULE-5656132343, 3-(1H-imidazol-5-ylmethylidene)-1H-indol-2-one, 186611-44-9

Molecular Formula: C12H9N3OMolecular Weight: 211.224 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VEEGZPWAAPPXRB-UHFFFAOYSA-N

372164-71-1
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