Chem
J-GLOBAL ID：200907063566283460
Nikkaji number：J2.389.915I
(1R,5α)-1α-(3-Butenyl)-4β-[2-(2-methyl-2-propenyl)-3,6-dimethoxyphenyl]-3,6-dioxabicyclo[3.1.0]hexane-2-one
(1R,5α)-1α-(3-ブテニル)-4β-[2-(2-メチル-2-プロペニル)-3,6-ジメトキシフェニル]-3,6-ジオキサビシクロ[3.1.0]ヘキサン-2-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： C20H24O5
Molecular formula furigana： C20-H24-O5
Molecular weight： 344.407
InChI：
InChI=1S/C20H24O5/c1-6-7-10-20-18(25-20)17(24-19(20)21)16-13(11-12(2)3)14(22-4)8-9-15(16)23-5/h6,8-9,17-18H,1-2,7,10-11H2,3-5H3/t17-,18+,20+/m0/s1
InChI key：
LVEUREQNOAQNKD-NLWGTHIKSA-N
SMILES：
COc1ccc(OC)c([C@@H]2OC(=O)[C@]3(CCC=C)O[C@H]23)c1CC(=C)C
Systematic name (3)：
- (1R,5α)-1α-(3-ブテニル)-4β-[2-(2-メチル-2-プロペニル)-3,6-ジメトキシフェニル]-3,6-ジオキサビシクロ[3.1.0]ヘキサン-2-オン
- (1R,4S,5R)-1-(ブタ-3-エン-1-イル)-4-[3,6-ジメトキシ-2-(2-メチルプロパ-2-エン-1-イル)フェニル]-3,6-ジオキサビシクロ[3.1.0]ヘキサン-2-オン
- (1R,4S,5R)-1-(but-3-en-1-yl)-4-[3,6-dimethoxy-2-(2-methylprop-2-en-1-yl)phenyl]-3,6-dioxabicyclo[3.1.0]hexan-2-one
- (1R,5α)-1α-(3-Butenyl)-4β-[2-(2-methyl-2-propenyl)-3,6-dimethoxyphenyl]-3,6-dioxabicyclo[3.1.0]hexane-2-one
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