Chem
J-GLOBAL ID:200907052604524130
Nikkaji number:J2.069.362B
(19R)-19-Hydroxy-19-methoxyandrosta-4-ene-3,6,17-trione
(19R)-19-ヒドロキシ-19-メトキシアンドロスタ-4-エン-3,6,17-トリオン
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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:
C20 H26 O5
Molecular formula furigana:
C20-H26-O5
Molecular weight:
346.423
InChI:
InChI=1S/C20H26O5/c1-19-7-6-14-12(13(19)3-4-17(19)23)10-16(22)15-9-11(21)5-8-20(14,15)18(24)25-2/h9,12-14,18,24H,3-8,10H2,1-2H3/t12-,13-,14-,18+,19-,20-/m0/s1
InChI key:
HENGAVQYPQETAK-RUNITJMPSA-N
SMILES:
CO[C@@H](O)[C@]12CCC(=O)C=C1C(=O)C[C@H]1[C@@H]3CCC(=O)[C@@]3(C)CC[C@H]21
Systematic name (3):
(19R)-19-ヒドロキシ-19-メトキシアンドロスタ-4-エン-3,6,17-トリオン
(3aS,3bR,9aS,9bS,11aS)-9a-[(R)-ヒドロキシ(メトキシ)メチル]-11a-メチル-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-1,5,7-トリオン
(3aS,3bR,9aS,9bS,11aS)-9a-[(R)-hydroxy(methoxy)methyl]-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,5,7-trione
Other name (1):
(19R)-19-Hydroxy-19-methoxyandrosta-4-ene-3,6,17-trione
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