Chem
J-GLOBAL ID:201207042917851913   Nikkaji number:J3.091.767G

Formosterol B

ホルモステロールB
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: C28H42O7
Molecular formula furigana: C28-H42-O7
Molecular weight: 490.637
InChI: InChI=1S/C28H42O7/c1-13(22-23(35-22)14(2)25(3,4)33)19-18(30)12-28(34)17-8-7-15-11-16(29)9-10-26(15,5)20(17)21(31)24(32)27(19,28)6/h8,13-15,18-20,22-24,30,32-34H,7,9-12H2,1-6H3/t13-,14-,15?,18-,19-,20+,22-,23+,24-,26-,27-,28-/m0/s1
InChI key: RZIUDOGWMCMHAN-JYSOCDEWSA-N
SMILES: C[C@H]([C@@H]1O[C@@H]1[C@H](C)C(C)(C)O)[C@H]1[C@@H](O)C[C@]2(O)C3=CCC4CC(=O)CC[C@]4(C)[C@H]3C(=O)[C@H](O)[C@]12C
Systematic name  (3):
  • (22S,23R)-22,23-エポキシ-12α,14β,16β,25-テトラヒドロキシエルゴスタ-7-エン-3,11-ジオン
  • (1R,2S,3aS,9aS,9bR,11R,11aS)-2,3a,11-トリヒドロキシ-1-[(1S)-1-[(2S,3R)-3-[(2S)-3-ヒドロキシ-3-メチルブタン-2-イル]オキシラン-2-イル]エチル]-9a,11a-ジメチル-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7,10-ジオン
  • (1R,2S,3aS,9aS,9bR,11R,11aS)-2,3a,11-trihydroxy-1-[(1S)-1-[(2S,3R)-3-[(2S)-3-hydroxy-3-methylbutan-2-yl]oxiran-2-yl]ethyl]-9a,11a-dimethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-7,10-dione
Other name (3):
  • (22S,23R)-22,23-Epoxy-12α,14β,16β,25-tetrahydroxyergosta-7-ene-3,11-dione
  • ホルモステロールB
  • Formosterol B
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