Chem
J-GLOBAL ID:200907075075060408   Nikkaji number:J799.282C

3β-Vinyloxycholest-4-ene

4-コレステ-3β-ニルビニルエーテル
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: C29H48O
Molecular formula furigana: C29-H48-O
Molecular weight: 412.702
InChI: InChI=1S/C29H48O/c1-7-30-23-15-17-28(5)22(19-23)11-12-24-26-14-13-25(21(4)10-8-9-20(2)3)29(26,6)18-16-27(24)28/h7,19-21,23-27H,1,8-18H2,2-6H3/t21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
InChI key: QRKFSDNRAIVHSI-AXYOXNHISA-N
SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC=C
Systematic name  (3):
  • 3β-ビニルオキシコレスタ-4-エン
  • (1R,3aS,3bS,7S,9aR,9bS,11aR)-7-(エテニルオキシ)-9a,11a-ジメチル-1-[(2R)-6-メチルヘプタン-2-イル]-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン
  • (1R,3aS,3bS,7S,9aR,9bS,11aR)-7-(ethenyloxy)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene
Other name (2):
  • 4-コレステ-3β-ニルビニルエーテル
  • 3β-Vinyloxycholest-4-ene
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