Chem
J-GLOBAL ID：200907019227527032   Nikkaji number：J1.676.964I

(4R)-4α,7β-Dimethyl-8α-(3-oxobutyl)-3,4,4aβ,5,6,7,8,8a-octahydro-1H-2-benzopyran-1β-ol

4-[(1S,4R,4aS,7R,8S)-1-ヒドロキシ-4,7-ジメチル-オクタヒドロ-1H-2-ベンゾピラン-8-イル]ブタン-2-オン
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： C15H26O3
Molecular formula furigana： C15-H26-O3
Molecular weight： 254.370
InChI： InChI=1S/C15H26O3/c1-9-4-6-13-10(2)8-18-15(17)14(13)12(9)7-5-11(3)16/h9-10,12-15,17H,4-8H2,1-3H3/t9-,10+,12+,13+,14?,15+/m1/s1
InChI key： BZTRTQXICHCWTD-WOPCHVMGSA-N
SMILES： C[C@@H]1CC[C@H]2[C@@H](C)CO[C@H](O)C2[C@H]1CCC(=O)C
Systematic name  (3)：
  • (4R)-4α,7β-ジメチル-8α-(3-オキソブチル)-3,4,4aβ,5,6,7,8,8a-オクタヒドロ-1H-2-ベンゾピラン-1β-オール
  • 4-[(1S,4R,4aS,7R,8S)-1-ヒドロキシ-4,7-ジメチル-オクタヒドロ-1H-2-ベンゾピラン-8-イル]ブタン-2-オン
  • 4-[(1S,4R,4aS,7R,8S)-1-hydroxy-4,7-dimethyl-octahydro-1H-2-benzopyran-8-yl]butan-2-one
Other name (1)：
  • (4R)-4α,7β-Dimethyl-8α-(3-oxobutyl)-3,4,4aβ,5,6,7,8,8a-octahydro-1H-2-benzopyran-1β-ol
Thsaurus map：
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