Chem
J-GLOBAL ID：200907016742370090   Nikkaji number：J14.208E

Sarcostin

サルコスチン
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： C21H34O6
Molecular formula furigana： C21-H34-O6
Molecular weight： 382.497
InChI： InChI=1S/C21H34O6/c1-12(22)19(25)8-9-21(27)18(19,3)16(24)11-15-17(2)6-5-14(23)10-13(17)4-7-20(15,21)26/h4,12,14-16,22-27H,5-11H2,1-3H3/t12-,14-,15+,16+,17-,18+,19+,20-,21+/m0/s1
InChI key： WIOBOUWMWWLZKG-QBZJCNLTSA-N
SMILES： C[C@H](O)[C@]1(O)CC[C@@]2(O)[C@]1(C)[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21O
Systematic name  (3)：
  • (14β,17S,20S)-プレグナ-5-エン-3β,8,12β,14,17,20-ヘキサオール
  • (1S,3aR,3bS,7S,9aR,9bR,11R,11aR)-1-[(1S)-1-ヒドロキシエチル]-9a,11a-ジメチル-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-1,3a,3b,7,11-ペンタオール
  • (1S,3aR,3bS,7S,9aR,9bR,11R,11aR)-1-[(1S)-1-hydroxyethyl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,3a,3b,7,11-pentol
Other name (3)：
  • サルコスチン
  • Sarcostin
  • (14β,17S,20S)-Pregn-5-ene-3β,8,12β,14,17,20-hexol
CAS registry number： 18607-76-6
KEGG COMPOUND： C17770
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