Chem
J-GLOBAL ID：200907066605613757   Nikkaji number：J1.828.392A

7α-Hydroxypetrosterol

7α-ヒドロキシペトロステロール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C29H48O2
Molecular formula furigana： C29-H48-O2
Molecular weight： 428.701
InChI： InChI=1S/C29H48O2/c1-17(22-14-19(22)3)6-7-18(2)23-8-9-24-27-25(11-13-29(23,24)5)28(4)12-10-21(30)15-20(28)16-26(27)31/h16-19,21-27,30-31H,6-15H2,1-5H3/t17-,18-,19-,21+,22+,23-,24+,25+,26-,27+,28+,29-/m1/s1
InChI key： MZWGMLRFWCUWKY-SMOIVPLOSA-N
SMILES： C[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)[C@@H]1C[C@H]1C
Systematic name  (3)：
  • (24R,25R,27R)-24,27-ジメチル-26,27-シクロコレスタ-5-エン-3β,7α-ジオール
  • (1R,3aS,3bS,4S,7S,9aR,9bS,11aR)-9a,11a-ジメチル-1-[(2R,5R)-5-[(1R,2R)-2-メチルシクロプロピル]ヘキサン-2-イル]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-4,7-ジオール
  • (1R,3aS,3bS,4S,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R,5R)-5-[(1R,2R)-2-methylcyclopropyl]hexan-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-4,7-diol
Other name (3)：
  • (24R,25R,27R)-24,27-Dimethyl-26,27-cyclocholesta-5-ene-3β,7α-diol
  • 7α-ヒドロキシペトロステロール
  • 7α-Hydroxypetrosterol
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