Vitas-M small molecule compound
4-{(2E)-2-[(1-methyl-1H-indol-3-yl)methylidene]-3,7-dioxo-2,3,8,9-tetrahydro-7H-furo[2,3-f]chromen-9-yl}benzoic acid
Catalog ID
STL543155
SMILES O=C1Oc2ccc3c(c2C(C1)c1ccc(cc1)C(=O)O)O/C(=C/c1cn(c2c1cccc2)C)/C3=O
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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 C28H19NO6 MW 465.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H19NO6/c1-29-14-17(18-4-2-3-5-21(18)29)12-23-26(31)19-10-11-22-25(27(19)35-23)20(13-24(30)34-22)15-6-8-16(9-7-15)28(32)33/h2-12,14,20H,13H2,1H3,(H,32,33)/b23-12+InChIKey
XSYVZALYAVMGEC-FSJBWODESA-NSynonyms
(Z)4(2((1methyl1Hindol3yl)methylene)37dioxo3789tetrahydro2Hfuro(23f)chromen9yl)benzoicacid
110207088
4((2~(E))2((1methylindol3yl)methylidene)37dioxo89dihydrofuro(23f)chromen9yl)benzoicacid
4((2E)2((1methyl1Hindol3yl)methylidene)37dioxo2389tetrahydro7Hfuro(23f)chromen9yl)benzoicacid
InChI=1SC28H19NO6c1291417(18423521(18)29)122326(31)1910112225(27(19)3523)20(1324(30)3422)156816(9715)28(32)33h2121420H13H21H3(H3233)b2312+
MFCD29055992
O=C1Oc2ccc3c(c2C(C1)c1ccc(cc1)C(=O)O)OC(=Cc1cn(c2c1cccc2)C)C3=O
ZINC000253414536
ZINC000253414538
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