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3,5-DIMETHOXYBENZYL-[5R-(5-ALPHA,6-ALPHA)]-5,6,7,8-TETRAHYDRO-7-METHYLIDENE-8-OXO-5-(3,4,5-TRIMETHOXYPHENYL)-NAPHTHO-[2,3-D]-[1,3]-DIOXOLE-6-CARBOXYLATE
SpectraBase Compound ID HymiIncmpjw
InChI InChI=1S/C31H30O10/c1-16-27(31(33)39-14-17-7-19(34-2)11-20(8-17)35-3)28(18-9-25(36-4)30(38-6)26(10-18)37-5)21-12-23-24(41-15-40-23)13-22(21)29(16)32/h7-13,27-28H,1,14-15H2,2-6H3/t27-,28+/m0/s1
InChIKey LCVNNKUIGXZIQF-WUFINQPMSA-N
Mol Weight 562.57 g/mol
Molecular Formula C31H30O10
Exact Mass 562.183897 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nRZ2pNidlo
Name (3,5-dimethoxyphenyl)methyl (7R,8R)-6-methylene-5-oxo-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylate
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Formula C31H30O10
InChI InChI=1S/C31H30O10/c1-16-27(31(33)39-14-17-7-19(34-2)11-20(8-17)35-3)28(18-9-25(36-4)30(38-6)26(10-18)37-5)21-12-23-24(41-15-40-23)13-22(21)29(16)32/h7-13,27-28H,1,14-15H2,2-6H3/t27-,28+/m0/s1
InChIKey LCVNNKUIGXZIQF-WUFINQPMSA-N
Molecular Weight 562.571 g/mol
SMILES C1([C@@]([C@](c2cc(OC)c(c(c2)OC)OC)(c2c(C1=O)cc1c(OCO1)c2)[H])(C(OCc1cc(OC)cc(c1)OC)=O)[H])=C
SPLASH splash10-014i-4009000000-93dd6432916d0bc4e7df
Source of Spectrum H-77-776-10
Synonyms (3,5-dimethoxyphenyl)methyl (7R,8R)-6-methylidene-5-oxidanylidene-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylate (3,5-dimethoxyphenyl)methyl (7R,8R)-6-methylidene-5-oxo-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylate (7R,8R)-5-keto-6-methylene-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylic acid (3,5-dimethoxybenzyl) ester (7R,8R)-6-methylene-5-oxo-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylic acid (3,5-dimethoxyphenyl)methyl ester
Wiley ID 1406930