Vitas-M small molecule compound
dimethyl 3,3'-(2,5-dihydroxy-3,6-dioxocyclohexa-1,4-diene-1,4-diyl)bis[3-(6-methoxy-4-oxo-4H-chromen-3-yl)propanoate]
Catalog ID
STL544677
SMILES COC(=O)CC(c1coc2c(c1=O)cc(cc2)OC)C1=C(O)C(=O)C(=C(C1=O)O)C(c1coc2c(c1=O)cc(cc2)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 C34H28O14 MW 660.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28O14/c1-43-15-5-7-23-19(9-15)29(37)21(13-47-23)17(11-25(35)45-3)27-31(39)33(41)28(34(42)32(27)40)18(12-26(36)46-4)22-14-48-24-8-6-16(44-2)10-20(24)30(22)38/h5-10,13-14,17-18,39,42H,11-12H2,1-4H3InChIKey
UVCIPXJFZHKDFK-UHFFFAOYSA-NSynonyms
1676073-79-2102564519
1676073792
dimethyl33(25dihydroxy36dioxocyclohexa14diene14diyl)bis(3(6methoxy4oxo4Hchromen3yl)propanoate)
InChI=1SC34H28O14c14315572319(915)29(37)21(134723)17(1125(35)453)2731(39)33(41)28(34(42)32(27)40)18(1226(36)464)221448248616(442)1020(24)30(22)38h510131417183942H1112H214H3
methyl3(25dihydroxy4(3methoxy1(6methoxy4oxochromen3yl)3oxopropyl)36dioxocyclohexa14dien1yl)3(6methoxy4oxochromen3yl)propanoate
MFCD28985414
ZINC000217957849
ZINC000217958012
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