Vitas-M small molecule compound
3-{(2Z)-6-hydroxy-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-7-yl}-3-(pyridin-3-yl)propanoic acid
Catalog ID
STL566329
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3C(c1cccnc1)CC(=O)O)O)cn2C
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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 C27H22N2O6 MW 470.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O6/c1-29-14-16(19-11-17(34-2)5-7-21(19)29)10-23-26(33)18-6-8-22(30)25(27(18)35-23)20(12-24(31)32)15-4-3-9-28-13-15/h3-11,13-14,20,30H,12H2,1-2H3,(H,31,32)/b23-10-InChIKey
UBDMYKCKWIFGRE-RMORIDSASA-NSynonyms
(Z)3(6hydroxy2((5methoxy1methyl1Hindol3yl)methylene)3oxo23dihydrobenzofuran7yl)3(pyridin3yl)propanoicacid
122170218
3((2Z)6hydroxy2((5methoxy1methyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran7yl)3(pyridin3yl)propanoicacid
3((2Z)6hydroxy2((5methoxy1methylindol3yl)methylidene)3oxo1benzofuran7yl)3pyridin3ylpropanoicacid
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3C(c1cccnc1)CC(=O)O)O)cn2C
InChI=1SC27H22N2O6c1291416(191117(342)5721(19)29)102326(33)186822(30)25(27(18)3523)20(1224(31)32)15439281315h31113142030H12H212H3(H3132)b2310
MFCD32651883
ZINC000409415619
ZINC001081802715
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