Vitas-M small molecule compound
dimethyl 3,3'-(2,5-dihydroxy-3,6-dioxocyclohexa-1,4-diene-1,4-diyl)bis[3-(2,3,4-trimethoxyphenyl)propanoate]
Catalog ID
STL549125
SMILES COC(=O)CC(c1ccc(c(c1OC)OC)OC)C1=C(O)C(=O)C(=C(C1=O)O)C(c1ccc(c(c1OC)OC)OC)CC(=O)OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C32H36O14 MW 644.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H36O14/c1-39-19-11-9-15(29(43-5)31(19)45-7)17(13-21(33)41-3)23-25(35)27(37)24(28(38)26(23)36)18(14-22(34)42-4)16-10-12-20(40-2)32(46-8)30(16)44-6/h9-12,17-18,35,38H,13-14H2,1-8H3InChIKey
CLSQQKOGAJOKEI-UHFFFAOYSA-NSynonyms
1676081-78-9102564834
1676081789
dimethyl33(25dihydroxy36dioxocyclohexa14diene14diyl)bis(3(234trimethoxyphenyl)propanoate)
InChI=1SC32H36O14c1391911915(29(435)31(19)457)17(1321(33)413)2325(35)27(37)24(28(38)26(23)36)18(1422(34)424)16101220(402)32(468)30(16)446h91217183538H1314H218H3
methyl3(25dihydroxy4(3methoxy3oxo1(234trimethoxyphenyl)propyl)36dioxocyclohexa14dien1yl)3(234trimethoxyphenyl)propanoate
MFCD28985723
ZINC000218041116
ZINC000218041273
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