Chem
J-GLOBAL ID:200907009624977545
Nikkaji number:J567.127B
Anastrephin
アナストレフィン
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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:
C12 H18 O2
Molecular formula furigana:
C12-H18-O2
Molecular weight:
194.274
InChI:
InChI=1S/C12H18O2/c1-4-11(2)6-5-7-12(3)9(11)8-10(13)14-12/h4,9H,1,5-8H2,2-3H3/t9-,11-,12-/m0/s1
InChI key:
VWOPTUCATATVGQ-DLOVCJGASA-N
SMILES:
C[C@]12CCC[C@](C)(C=C)[C@@H]1CC(=O)O2
Systematic name (4):
(3aS,3aα)-4β-エテニルヘキサヒドロ-4,7aβ-ジメチルベンゾフラン-2(3H)-オン
(3aS,4R,7aS)-4,7a-ジメチル-4-ビニルオクタヒドロベンゾフラン-2-オン
(3aS,4R,7aS)-4-エテニル-4,7a-ジメチル-オクタヒドロ-1-ベンゾフラン-2-オン
(3aS,4R,7aS)-4-ethenyl-4,7a-dimethyl-octahydro-1-benzofuran-2-one
Other name (6):
(-)-アナストレフィン
アナストレフィン
(-)-Anastrephin
Anastrephin
(3aS,3aα)-4β-Ethenylhexahydro-4,7aβ-dimethylbenzofuran-2(3H)-one
(3aS,4R,7aS)-4,7a-Dimethyl-4-vinyloctahydrobenzofuran-2-one
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CAS registry number:
77670-94-1
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