类固醇和类固醇衍生物

描述:

基于环戊[a]菲碳骨架的化合物，部分或完全氢化；通常在C-10和C-13位存在甲基，C-17位常含烷基。扩展而言，骨架可能发生单键或多键断裂、环扩张及/或环收缩。

上级分类:

有机化合物 ⮕ 脂质和脂质样分子 ⮕ 类固醇和类固醇衍生物

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Kenalog
CAS: 352431-33-5 化合物 CID: 121231051

期货货号: K977122

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技术标识符

IUPAC名称

(4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-6,6-bis(trideuteriomethyl)-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one

SMILES

CC1(OC2CC3C4CCC5=CC(=O)C=CC5(C4(C(CC3(C2(O1)C(=O)CO)C)O)F)C)C

InChIKey

YNDXUCZADRHECN-YOWSACAVSA-N

InChI

1S/C24H31FO6/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,25)17(28)11-22(16,4)24(19,31-20)18(29)12-26/h7-9,15-17,19,26,28H,5-6,10-12H2,1-4H3/t15?,16?,17-,19+,21-,22-,23-,24+/m0/s1/i1D3,2D3
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Beta-Cortol
CAS: 667-65-2 分子式: C₂₁H₃₆O₅ 分子量: 368.51

Moligand™ ? ≥98%

有现货货号: B1051826

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技术标识符

IUPAC名称

(3R,5R,8S,9S,10S,11S,13S,14S,17R)-17-[(1R)-1,2-dihydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,11,17-triol

SMILES

CC12CCC(CC1CCC3C2C(CC4(C3CCC4(C(CO)O)O)C)O)O

InChIKey

FFPUNPBUZDTHJI-ZFOKFBPFSA-N

InChI

1S/C21H36O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-18,22-26H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,17-,18-,19+,20+,21+/m1/s1
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二氢葫芦素 B
CAS: 13201-14-4 分子式: C₃₂H₄₈O₈ 分子量: 560.700

期货货号: D1058203

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技术标识符

IUPAC名称

[(6R)-6-[(2S,8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxoheptan-2-yl] acetate

SMILES

CC(=O)OC(C)(C)CCC(=O)[C@@](C)([C@H]1[C@@H](C[C@@]2([C@@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C[C@@H](C(=O)C4(C)C)O)C)C)C)O)O

InChIKey

QZJJDOYZVRUEDY-NRNCYQGDSA-N

InChI

1S/C32H48O8/c1-17(33)40-27(2,3)13-12-23(36)32(9,39)25-21(35)15-29(6)22-11-10-18-19(14-20(34)26(38)28(18,4)5)31(22,8)24(37)16-30(25,29)7/h10,19-22,25,34-35,39H,11-16H2,1-9H3/t19-,20+,21-,22+,25+,29+,30显示更多
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Dexamethasone Metasulfobenzoate Sodium
CAS: 3936-02-5 EC号: 223-514-9 分子式: C₂₉H₃₂FNaO₉S 分子量: 598.6

期货货号: D1282255

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技术标识符

IUPAC名称

sodium;3-[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]carbonylbenzenesulfonate

SMILES

C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COC(=O)C5=CC(=CC=C5)S(=O)(=O)[O-])O)C)O)F)C.[Na+]

InChIKey

RPBJOYICBFNIMN-RDWMNNCQSA-M

InChI

1S/C29H33FO9S.Na/c1-16-11-22-21-8-7-18-13-19(31)9-10-26(18,2)28(21,30)23(32)14-27(22,3)29(16,35)24(33)15-39-25(34)17-5-4-6-20(12-17)40(36,37)38;/h4-6,9-10,12-13,16,21-23,32,35H,7-8,11,14-15H2,1-3H3,(H显示更多
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BAR 501 impurity
CAS: 1632118-70-7 化合物 CID: 101886306

期货货号: B1295178

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技术标识符

IUPAC名称

(3R,5S,6S,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-17-[(2R)-5-hydroxypentan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

SMILES

CCC1C2CC(CCC2(C3CCC4(C(C3C1O)CCC4C(C)CCCO)C)C)O

InChIKey

DQBAHTQWQZRMFH-GRVUFFLBSA-N

InChI

1S/C26H46O3/c1-5-18-22-15-17(28)10-12-26(22,4)21-11-13-25(3)19(16(2)7-6-14-27)8-9-20(25)23(21)24(18)29/h16-24,27-29H,5-15H2,1-4H3/t16-,17-,18+,19-,20+,21+,22+,23+,24-,25-,26-/m1/s1
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5-Dehydroepisterol
CAS: 23582-83-4 化合物 CID: 10894570 分子式: C₂₈H₄₄O 分子量: 396.65

期货货号: D1044140

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技术标识符

IUPAC名称

(3S,9S,10R,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

SMILES

CC(C)C(=C)CCC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C

InChIKey

ZEPNVCGPJXYABB-LOIOQLKMSA-N

InChI

1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9-10,18,20,22,24-26,29H,3,7-8,11-17H2,1-2,4-6H3/t20-,22+,24-,25+,26+,27+,28-/m1/s1
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4beta-Hydroxywithanolide E
CAS: 54334-04-2 分子式: C₂₈H₃₈O₈ 分子量: 502.600

期货货号: B1019114

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技术标识符

IUPAC名称

(1S,2R,6S,7R,9R,11R,12R,15S,16S)-15-[(1S)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-6,12,15-trihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one

SMILES

CC1=C(C(=O)O[C@H](C1)[C@@](C)([C@@]2(CC[C@@]3([C@@]2(CC[C@H]4[C@H]3C[C@@H]5[C@]6([C@@]4(C(=O)C=C[C@@H]6O)C)O5)C)O)O)O)C

InChIKey

UPBUGICUKQIKTJ-KABTZXSUSA-N

InChI

1S/C28H38O8/c1-14-12-20(35-22(31)15(14)2)25(5,32)27(34)11-10-26(33)17-13-21-28(36-21)19(30)7-6-18(29)24(28,4)16(17)8-9-23(26,27)3/h6-7,16-17,19-21,30,32-34H,8-13H2,1-5H3/t16-,17+,19-,20+,21+,23-,24-,2显示更多
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4-Methoxyestradiol
CAS: 26788-23-8 化合物 CID: 68578 分子式: C₁₉H₂₆O₃ 分子量: 302.41

期货货号: M1053515

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技术标识符

IUPAC名称

(8R,9S,13S,14S,17S)-4-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol

SMILES

CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4OC)O

InChIKey

BCWZIZLVBYHFES-PYEWSWHRSA-N

InChI

1S/C19H26O3/c1-19-10-9-12-11-5-7-16(20)18(22-2)14(11)4-3-13(12)15(19)6-8-17(19)21/h5,7,12-13,15,17,20-21H,3-4,6,8-10H2,1-2H3/t12-,13-,15+,17+,19+/m1/s1
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2-溴 17β-雌二醇
CAS: 15833-07-5 化合物 CID: 266713 分子式: C₁₈H₂₃BrO₂ 分子量: 351.28

Moligand™ ? ≥98%

有现货货号: B1240612

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技术标识符

IUPAC名称

2-bromo-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol

SMILES

CC12CCC3C(C1CCC2O)CCC4=CC(=C(C=C34)Br)O

InChIKey

SORISAYAZBCIQH-UHFFFAOYSA-N

InChI

1S/C18H23BrO2/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-16(20)15(19)9-13(10)11/h8-9,11-12,14,17,20-21H,2-7H2,1H3
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3-epi-vitamin D3
CAS: 57651-82-8 分子式: C₂₇H₄₄O 分子量: 384.6

期货货号: E1315776

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技术标识符

IUPAC名称

(1R,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol

SMILES

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@@H](CCC3=C)O)C

InChIKey

QYSXJUFSXHHAJI-YHJXBONMSA-N

InChI

1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h12-13,19,21,24-26,28H,3,6-11,14-18H2,1-2,4-5H3/b22-12+,23-13-/t21-,24-,25-,26+,27-/m1/s1
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3-Oxochola-4,6-dien-24-oic Acid
CAS: 88179-71-9 化合物 CID: 5283992 分子式: C₂₄H₃₄O₃ 分子量: 370.52

≥99%

期货货号: O1057203

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技术标识符

IUPAC名称

(4R)-4-[(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-oxo-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid

SMILES

CC(CCC(=O)O)C1CCC2C1(CCC3C2C=CC4=CC(=O)CCC34C)C

InChIKey

CREVIXFSUWYGRJ-IHMUCKAYSA-N

InChI

1S/C24H34O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h5-6,14-15,18-21H,4,7-13H2,1-3H3,(H,26,27)/t15-,18+,19-,20+,21+,23+,24-/m1/s1
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胆固醇-d
CAS: 956029-28-0 化合物 CID: 71314810 分子式: C₂₇H₄₂D₄O 分子量: 390.68

≥99%

期货货号: B987467

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技术标识符

IUPAC名称

(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C

InChIKey

HVYWMOMLDIMFJA-CRNPSRDESA-N

InChI

1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1/i1D3,18D/t18?,19-,21+,22+显示更多