Vitas-M small molecule compound

dimethyl 3,3'-(2,5-dihydroxy-3,6-dioxocyclohexa-1,4-diene-1,4-diyl)bis[3-(2,4,5-trimethoxyphenyl)propanoate]

Catalog ID
STL544681
SMILES COC(=O)CC(c1cc(OC)c(cc1OC)OC)C1=C(O)C(=O)C(=C(C1=O)O)C(c1cc(OC)c(cc1OC)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/c1-39-19-13-23(43-5)21(41-3)9-15(19)17(11-25(33)45-7)27-29(35)31(37)28(32(38)30(27)36)18(12-26(34)46-8)16-10-22(42-4)24(44-6)14-20(16)40-2/h9-10,13-14,17-18,35,38H,11-12H2,1-8H3
InChIKey
HVDKRQXKVIRKEH-UHFFFAOYSA-N
Synonyms
1676086-24-0
102564623
1676086240
dimethyl33(25dihydroxy36dioxocyclohexa14diene14diyl)bis(3(245trimethoxyphenyl)propanoate)
InChI=1SC32H36O14c139191323(435)21(413)915(19)17(1125(33)457)2729(35)31(37)28(32(38)30(27)36)18(1226(34)468)161022(424)24(446)1420(16)402h910131417183538H1112H218H3
methyl3(25dihydroxy4(3methoxy3oxo1(245trimethoxyphenyl)propyl)36dioxocyclohexa14dien1yl)3(245trimethoxyphenyl)propanoate
MFCD28985531
ZINC000217986598
ZINC000217986761

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Available files

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