Vitas-M small molecule compound
4-[(2E)-3,7-dioxo-2-(2,4,5-trimethoxybenzylidene)-2,3,8,9-tetrahydro-7H-furo[2,3-f]chromen-9-yl]benzoic acid
Catalog ID
STL544282
SMILES COc1cc(OC)c(cc1/C=C\1/Oc2c(C1=O)ccc1c2C(CC(=O)O1)c1ccc(cc1)C(=O)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 C28H22O9 MW 502.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22O9/c1-33-20-13-22(35-3)21(34-2)10-16(20)11-23-26(30)17-8-9-19-25(27(17)37-23)18(12-24(29)36-19)14-4-6-15(7-5-14)28(31)32/h4-11,13,18H,12H2,1-3H3,(H,31,32)/b23-11+InChIKey
QUTLXTSEGMYDKJ-FOKLQQMPSA-NSynonyms
(Z)4(37dioxo2(245trimethoxybenzylidene)3789tetrahydro2Hfuro(23f)chromen9yl)benzoicacid
110207474
4((2~(E))37dioxo2((245trimethoxyphenyl)methylidene)89dihydrofuro(23f)chromen9yl)benzoicacid
4((2E)37dioxo2(245trimethoxybenzylidene)2389tetrahydro7Hfuro(23f)chromen9yl)benzoicacid
COc1cc(OC)c(cc1C=C1Oc2c(C1=O)ccc1c2C(CC(=O)O1)c1ccc(cc1)C(=O)O)OC
InChI=1SC28H22O9c133201322(353)21(342)1016(20)112326(30)17891925(27(17)3723)18(1224(29)3619)144615(7514)28(31)32h4111318H12H213H3(H3132)b2311+
MFCD29056178
ZINC000253412376
ZINC000253412377
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