Chem
J-GLOBAL ID：200907048641796592
Nikkaji number：J2.395.586E
Stereochenol B
ステレオケノールB
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： C20H20O4
Molecular formula furigana： C20-H20-O4
Molecular weight： 324.376
InChI：
InChI=1S/C20H20O4/c1-18(10-21)13-7-8-19(2)14(13)9-15-16(22)11-5-3-4-6-12(11)17(23)20(15,18)24-19/h3-6,9,13-14,21H,7-8,10H2,1-2H3/t13-,14-,18+,19+,20-/m0/s1
InChI key：
LVKFIUJKCJIOSX-NHQIJDEQSA-N
SMILES：
C[C@@]12CC[C@H]3[C@@H]1C=C1C(=O)c4ccccc4C(=O)[C@]1(O2)[C@]3(C)CO
Systematic name (3)：
- (3R,3aS,10aS,11S,11aS)-2,3,3aα,5,10,10aα,11,11aα-オクタヒドロ-3,11-ジメチル-11-(ヒドロキシメチル)-3β,10aβ-エポキシ-1H-シクロペンタ[b]アントラセン-5,10-ジオン
- (1S,12S,13S,16R,18S)-18-(ヒドロキシメチル)-16,18-ジメチル-17-オキサペンタシクロ[11.4.1.01,10.03,8.012,16]オクタデカ-3,5,7,10-テトラエン-2,9-ジオン
- (1S,12S,13S,16R,18S)-18-(hydroxymethyl)-16,18-dimethyl-17-oxapentacyclo[11.4.1.01,10.03,8.012,16]octadeca-3,5,7,10-tetraene-2,9-dione
- (3R,3aS,10aS,11S,11aS)-2,3,3aα,5,10,10aα,11,11aα-Octahydro-3,11-dimethyl-11-(hydroxymethyl)-3β,10aβ-epoxy-1H-cyclopenta[b]anthracene-5,10-dione
- ステレオケノールB
- Stereochenol B
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