Chem
J-GLOBAL ID：200907078665436291
Nikkaji number：J1.008.822D
(5R)-3,8α-Dimethyl-5α-(1-methyl-1-hydroxyethyl)-1,2,4,5,6,7,8,8aα-octahydroazulene-2,6-dione
(5R)-3,8α-ジメチル-5α-(1-メチル-1-ヒドロキシエチル)-1,2,4,5,6,7,8,8aα-オクタヒドロアズレン-2,6-ジオン
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： C15H22O3
Molecular formula furigana： C15-H22-O3
Molecular weight： 250.338
InChI：
InChI=1S/C15H22O3/c1-8-5-14(17)12(15(3,4)18)6-11-9(2)13(16)7-10(8)11/h8,10,12,18H,5-7H2,1-4H3/t8-,10+,12-/m0/s1
InChI key：
AHWVRKFHEYTCQZ-XRNSZHNASA-N
SMILES：
C[C@H]1CC(=O)[C@H](CC2=C(C)C(=O)C[C@H]12)C(C)(C)O
Systematic name (3)：
- (5R)-3,8α-ジメチル-5α-(1-メチル-1-ヒドロキシエチル)-1,2,4,5,6,7,8,8aα-オクタヒドロアズレン-2,6-ジオン
- (5R,8S,8aR)-5-(2-ヒドロキシプロパン-2-イル)-3,8-ジメチル-1,2,4,5,6,7,8,8a-オクタヒドロアズレン-2,6-ジオン
- (5R,8S,8aR)-5-(2-hydroxypropan-2-yl)-3,8-dimethyl-1,2,4,5,6,7,8,8a-octahydroazulene-2,6-dione
- (5R)-3,8α-Dimethyl-5α-(1-methyl-1-hydroxyethyl)-1,2,4,5,6,7,8,8aα-octahydroazulene-2,6-dione
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