Vitas-M small molecule compound
4-(5-{(2Z)-2-[(1-methyl-1H-indol-3-yl)methylidene]-3,7-dioxo-2,3,8,9-tetrahydro-7H-furo[2,3-f]chromen-9-yl}furan-2-yl)benzoic acid
Catalog ID
STL543135
SMILES O=C1Oc2ccc3c(c2C(C1)c1ccc(o1)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 C32H21NO7 MW 531.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H21NO7/c1-33-16-19(20-4-2-3-5-23(20)33)14-27-30(35)21-10-11-26-29(31(21)40-27)22(15-28(34)39-26)25-13-12-24(38-25)17-6-8-18(9-7-17)32(36)37/h2-14,16,22H,15H2,1H3,(H,36,37)/b27-14-InChIKey
PXIQSTQKIQUNML-VYYCAZPPSA-NSynonyms
(Z)4(5(2((1methyl1Hindol3yl)methylene)37dioxo3789tetrahydro2Hfuro(23f)chromen9yl)furan2yl)benzoicacid
110206319
4(5((2~(Z))2((1methylindol3yl)methylidene)37dioxo89dihydrofuro(23f)chromen9yl)furan2yl)benzoicacid
4(5((2Z)2((1methyl1Hindol3yl)methylidene)37dioxo2389tetrahydro7Hfuro(23f)chromen9yl)furan2yl)benzoicacid
InChI=1SC32H21NO7c1331619(20423523(20)33)142730(35)2110112629(31(21)4027)22(1528(34)3926)25131224(3825)176818(9717)32(36)37h2141622H15H21H3(H3637)b2714
MFCD29055637
O=C1Oc2ccc3c(c2C(C1)c1ccc(o1)c1ccc(cc1)C(=O)O)OC(=Cc1cn(c2c1cccc2)C)C3=O
ZINC000253412110
ZINC000253412111
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