Chem
J-GLOBAL ID:200907032885745910
Nikkaji number:J108.088A
16-Keto-estradiol
16-ケトエストラジオール
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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:
C18 H22 O3
Molecular formula furigana:
C18-H22-O3
Molecular weight:
286.371
InChI:
InChI=1S/C18H22O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-15,17,19,21H,2,4,6-7,9H2,1H3/t13-,14-,15+,17+,18+/m1/s1
InChI key:
KJDGFQJCHFJTRH-YONAWACDSA-N
SMILES:
C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC(=O)[C@@H]2O
Systematic name (7):
3,17β-ジヒドロキシエストラ-1,3,5(10)-トリエン-16-オン
3,17β-ジヒドロキシ-1,3,5(10)-エストラトリエン-16-オン
(17R)-3,17β-ジヒドロキシ-1,3,5(10)-エストラトリエン-16-オン
16-オキソ-17β-エストラジオール
3,17β-ジヒドロキシエストラ-1(10),2,4-トリエン-16-オン
(1R,3aS,3bR,9bS,11aS)-1,7-ジヒドロキシ-11a-メチル-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-2-オン
(1R,3aS,3bR,9bS,11aS)-1,7-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-2-one
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Other name (7):
3,17β-Dihydroxyestra-1,3,5(10)-trien-16-one
3,17β-Dihydroxy-1,3,5(10)-estratriene-16-one
(17R)-3,17β-Dihydroxy-1,3,5(10)-estratriene-16-one
16-Oxo-17β-estradiol
16-ケトエストラジオール
16-Keto-estradiol
3,17β-Dihydroxyestra-1(10),2,4-triene-16-one
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CAS registry number:
566-75-6
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