Chem
J-GLOBAL ID：200907094112591537
Nikkaji number：J1.859.310F
(4aS)-8α-Phenyl-3,4,4aα,7,8,8aβ-hexahydro-1H-2-benzopyran-1-one
(4aS)-8α-フェニル-3,4,4aα,7,8,8aβ-ヘキサヒドロ-1H-2-ベンゾピラン-1-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： C15H16O2
Molecular formula furigana： C15-H16-O2
Molecular weight： 228.291
InChI：
InChI=1S/C15H16O2/c16-15-14-12(9-10-17-15)7-4-8-13(14)11-5-2-1-3-6-11/h1-7,12-14H,8-10H2/t12-,13-,14-/m1/s1
InChI key：
OVXYSAPGNFVZLO-MGPQQGTHSA-N
SMILES：
O=C1OCC[C@H]2C=CC[C@@H]([C@H]12)c1ccccc1
Systematic name (3)：
- (4aS)-8α-フェニル-3,4,4aα,7,8,8aβ-ヘキサヒドロ-1H-2-ベンゾピラン-1-オン
- (4aS,8S,8aR)-8-フェニル-3,4,4a,7,8,8a-ヘキサヒドロ-1H-2-ベンゾピラン-1-オン
- (4aS,8S,8aR)-8-phenyl-3,4,4a,7,8,8a-hexahydro-1H-2-benzopyran-1-one
- (4aS)-8α-Phenyl-3,4,4aα,7,8,8aβ-hexahydro-1H-2-benzopyran-1-one
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