Chem
J-GLOBAL ID:200907063427244549
Nikkaji number:J10.412D
Dispermone
ジスペルモン
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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 H28 O3
Molecular formula furigana:
C20-H28-O3
Molecular weight:
316.441
InChI:
InChI=1S/C20H28O3/c1-11(2)16-17-12(9-14(22)18(16)23)20(5)8-6-7-19(3,4)15(20)10-13(17)21/h9,11,15,22-23H,6-8,10H2,1-5H3/t15-,20+/m0/s1
InChI key:
ZFRQAKIJVKSVOT-MGPUTAFESA-N
SMILES:
CC(C)c1c(O)c(O)cc2c1C(=O)C[C@H]1C(C)(C)CCC[C@]21C
Systematic name (3):
(4aS,10aS)-2,3,4,4a,10,10a-ヘキサヒドロ-8-イソプロピル-6,7-ジヒドロキシ-1,1,4a-トリメチルフェナントレン-9(1H)-オン
(4aS,10aS)-6,7-ジヒドロキシ-1,1,4a-トリメチル-8-(プロパン-2-イル)-1,2,3,4,4a,9,10,10a-オクタヒドロフェナントレン-9-オン
(4aS,10aS)-6,7-dihydroxy-1,1,4a-trimethyl-8-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthren-9-one
Other name (3):
ジスペルモン
Dispermone
(4aS,10aS)-2,3,4,4a,10,10a-Hexahydro-8-isopropyl-6,7-dihydroxy-1,1,4a-trimethylphenanthren-9(1H)-one
CAS registry number:
51918-95-7
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