Vitas-M small molecule compound

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

Catalog ID
STL544047
SMILES COC(=O)CC(c1ccc(cc1OC)OC)C1=C(O)C(=O)C(=C(C1=O)O)C(c1ccc(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 C30H32O12 MW 584.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32O12/c1-37-15-7-9-17(21(11-15)39-3)19(13-23(31)41-5)25-27(33)29(35)26(30(36)28(25)34)20(14-24(32)42-6)18-10-8-16(38-2)12-22(18)40-4/h7-12,19-20,33,36H,13-14H2,1-6H3
InChIKey
IXCBUHLMTMVGCT-UHFFFAOYSA-N
Synonyms
1676072-95-9
102564671
1676072959
dimethyl33(25dihydroxy36dioxocyclohexa14diene14diyl)bis(3(24dimethoxyphenyl)propanoate)
InChI=1SC30H32O12c137157917(21(1115)393)19(1323(31)415)2527(33)29(35)26(30(36)28(25)34)20(1424(32)426)1810816(382)1222(18)404h71219203336H1314H216H3
methyl3(24dimethoxyphenyl)3(4(1(24dimethoxyphenyl)3methoxy3oxopropyl)25dihydroxy36dioxocyclohexa14dien1yl)propanoate
MFCD28985579
ZINC000217998383
ZINC000217998537

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Available files

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