Chem
J-GLOBAL ID：200907042594192596
Nikkaji number：J1.489.224I
(3S,6R,9R)-2-Oxo-3-(4-methoxy-1,2-dihydrobenzocyclobutene-1-yl)-6,9-divinyl-1-oxaspiro[4.4]nonane-3-carboxylic acid methyl ester
(3S,6R,9R)-2-オキソ-3-(4-メトキシ-1,2-ジヒドロベンゾシクロブテン-1-イル)-6,9-ジビニル-1-オキサスピロ[4.4]ノナン-3-カルボン酸メチル
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： C23H26O5
Molecular formula furigana： C23-H26-O5
Molecular weight： 382.456
InChI：
InChI=1S/C23H26O5/c1-5-15-7-8-16(6-2)23(15)13-22(20(24)27-4,21(25)28-23)19-12-14-11-17(26-3)9-10-18(14)19/h5-6,9-11,15-16,19H,1-2,7-8,12-13H2,3-4H3/t15-,16-,19?,22-/m0/s1
InChI key：
WHCWABBLXZFLAR-DYICCPCSSA-N
SMILES：
COC(=O)[C@]1(CC2(OC1=O)[C@H](CC[C@@H]2C=C)C=C)C1Cc2cc(OC)ccc12
Systematic name (3)：
- (3S,6R,9R)-2-オキソ-3-(4-メトキシ-1,2-ジヒドロベンゾシクロブテン-1-イル)-6,9-ジビニル-1-オキサスピロ[4.4]ノナン-3-カルボン酸メチル
- メチル (3S,6R,9R)-6,9-ジエテニル-3-{3-メトキシビシクロ[4.2.0]オクタ-1,3,5-トリエン-7-イル}-2-オキソ-1-オキサスピロ[4.4]ノナン-3-カルボキシラート
- methyl (3S,6R,9R)-6,9-diethenyl-3-{3-methoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl}-2-oxo-1-oxaspiro[4.4]nonane-3-carboxylate
- (3S,6R,9R)-2-Oxo-3-(4-methoxy-1,2-dihydrobenzocyclobutene-1-yl)-6,9-divinyl-1-oxaspiro[4.4]nonane-3-carboxylic acid methyl ester
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