Chem
J-GLOBAL ID:200907064635430042
Nikkaji number:J1.679.658A
(3aS)-3aβ-(3,4-Dimethoxyphenyl)-6-hydroxy-6-methylhexahydro-2H-cyclopenta[b]furan-2-one
(3aS)-3aβ-(3,4-ジメトキシフェニル)-6-ヒドロキシ-6-メチルヘキサヒドロ-2H-シクロペンタ[b]フラン-2-オン
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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:
C16 H20 O5
Molecular formula furigana:
C16-H20-O5
Molecular weight:
292.331
InChI:
InChI=1S/C16H20O5/c1-15(18)6-7-16(9-13(17)21-14(15)16)10-4-5-11(19-2)12(8-10)20-3/h4-5,8,14,18H,6-7,9H2,1-3H3/t14?,15?,16-/m0/s1
InChI key:
KSENGMRZPYOFLJ-GPANFISMSA-N
SMILES:
COc1ccc(cc1OC)[C@@]12CCC(C)(O)C1OC(=O)C2
Systematic name (3):
(3aS)-3aβ-(3,4-ジメトキシフェニル)-6-ヒドロキシ-6-メチルヘキサヒドロ-2H-シクロペンタ[b]フラン-2-オン
(3aS)-3a-(3,4-ジメトキシフェニル)-6-ヒドロキシ-6-メチル-ヘキサヒドロ-2H-シクロペンタ[b]フラン-2-オン
(3aS)-3a-(3,4-dimethoxyphenyl)-6-hydroxy-6-methyl-hexahydro-2H-cyclopenta[b]furan-2-one
Other name (1):
(3aS)-3aβ-(3,4-Dimethoxyphenyl)-6-hydroxy-6-methylhexahydro-2H-cyclopenta[b]furan-2-one
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