2-(3,4-dihydroxyphenyl)-8-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chroman-4-yl]-6-methyl-chroman-3,5,7-triol

ChemSpider ID: 19536251
Molecular Formula: C₃₁H₂₈O₁₂
Average mass: 592.546814 Da
Monoisotopic mass: 592.158081 Da
Systematic name

2-(3,4-dihydroxyphenyl)-8-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chroman-4-yl]-6-methyl-chroman-3,5,7-triol
SMILES and InChIs

SMILES:

Oc1ccc(cc1O)C6Oc2cc(O)cc(O)c2C(c3c(O)c(C)c(O)c4CC(O)C(Oc34)c5ccc(O)c(O)c5)C6O Copied

Std. InChI:

InChI=1S/C31H28O12/c1-11-26(39)15-10-21(38)29(12-2-4-16(33)18(35)6-12)43-31(15)25(27(11)40)24-23-20(37)8-14(32)9-22(23)42-30(28(24)41)13-3-5-17(34)19(36)7-13/h2-9,21,24,28-30,32-41H,10H2,1H3 Copied

Std. InChIKey:

FQHYBZYGHOMBIL-UHFFFAOYSA-N Copied
Cite this record
CSID:19536251, http://www.chemspider.com/Chemical-Structure.19536251.html (accessed 21:12, May 24, 2012) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.