Chem
J-GLOBAL ID:200907075416601070
Nikkaji number:J7.660K
W-4540
酢酸キンゲスタニル
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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:
C27 H36 O3
Molecular formula furigana:
C27-H36-O3
Molecular weight:
408.582
InChI:
InChI=1S/C27H36O3/c1-4-27(30-18(2)28)16-14-25-24-11-9-19-17-21(29-20-7-5-6-8-20)10-12-22(19)23(24)13-15-26(25,27)3/h1,9,17,20,22-25H,5-8,10-16H2,2-3H3/t22-,23+,24+,25-,26-,27-/m0/s1
InChI key:
FLGJKPPXEKYCBY-AKCFYGDASA-N
SMILES:
CC(=O)O[C@]1(CC[C@H]2[C@@H]3CC=C4C=C(CC[C@@H]4[C@H]3CC[C@]12C)OC1CCCC1)C#C
Systematic name (4):
(17R)-3-シクロペンチルオキシ-19-ノルプレグナ-3,5-ジエン-20-イン-17-オールアセタート
(17R)-3-(シクロペンチルオキシ)-19-ノルプレグナ-3,5-ジエン-20-イン-17-オール17-アセタート
(1R,3aS,3bR,9aR,9bS,11aS)-7-(シクロペンチルオキシ)-1-エチニル-11a-メチル-1H,2H,3H,3aH,3bH,4H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1-イル アセタート
(1R,3aS,3bR,9aR,9bS,11aS)-7-(cyclopentyloxy)-1-ethynyl-11a-methyl-1H,2H,3H,3aH,3bH,4H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate
Other name (7):
キンゲスタノールアセタート
W 4540
Quingestanol acetate
酢酸キンゲスタニル
W-4540
(17R)-3-(Cyclopentyloxy)-19-norpregna-3,5-dien-20-yn-17-ol 17-acetate
(17R)-3-Cyclopentyloxy-19-norpregna-3,5-dien-20-yn-17-ol acetate
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CAS registry number:
3000-39-3
Regulation number (2):
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