Chem
J-GLOBAL ID：200907047433150887
Nikkaji number：J1.544.405C
3,4-Bis[2-(acryloyloxy)ethoxy]benzoic acid 17β-acetylandrosta-5-ene-3β-yl ester
3,4-ビス[2-(アクリロイルオキシ)エトキシ]安息香酸17β-アセチルアンドロスタ-5-エン-3β-イル
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
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
Molecular formula： C38H48O9
Molecular formula furigana： C38-H48-O9
Molecular weight： 648.793
InChI：
InChI=1S/C38H48O9/c1-6-34(40)45-20-18-43-32-13-8-25(22-33(32)44-19-21-46-35(41)7-2)36(42)47-27-14-16-37(4)26(23-27)9-10-28-30-12-11-29(24(3)39)38(30,5)17-15-31(28)37/h6-9,13,22,27-31H,1-2,10-12,14-21,23H2,3-5H3/t27-,28-,29+,30-,31-,37-,38+/m0/s1
InChI key：
ZMVGRYDSZMSNME-SUJBUFPNSA-N
SMILES：
CC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)c1ccc(OCCOC(=O)C=C)c(OCCOC(=O)C=C)c1
Systematic name (3)：
- 3,4-ビス[2-(アクリロイルオキシ)エトキシ]安息香酸17β-アセチルアンドロスタ-5-エン-3β-イル
- (1S,3aS,3bS,7S,9aR,9bS,11aS)-1-アセチル-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-7-イル 3,4-ビス[2-(プロパ-2-エノイルオキシ)エトキシ]ベンゾアート
- (1S,3aS,3bS,7S,9aR,9bS,11aS)-1-acetyl-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl 3,4-bis[2-(prop-2-enoyloxy)ethoxy]benzoate
- 3,4-Bis[2-(acryloyloxy)ethoxy]benzoic acid 17β-acetylandrosta-5-ene-3β-yl ester
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