Vitas-M small molecule compound
2,2'-[5-({4-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl}carbamoyl)benzene-1,3-diyl]bis(1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid)
Catalog ID
STK072317
SMILES O=C(c1cc(cc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O)Nc1ccc(cc1)/C=C/C(=O)c1ccccc1
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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 C40H23N3O10 MW 705.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H23N3O10/c44-33(22-4-2-1-3-5-22)15-8-21-6-11-26(12-7-21)41-34(45)25-16-27(42-35(46)29-13-9-23(39(50)51)18-31(29)37(42)48)20-28(17-25)43-36(47)30-14-10-24(40(52)53)19-32(30)38(43)49/h1-20H,(H,41,45)(H,50,51)(H,52,53)/b15-8+InChIKey
WJWRDBNAUIUGIE-OVCLIPMQSA-NSynonyms
2(3(5CARBOXY13DIOXOISOINDOL2YL)5((4((E)3OXO3PHENYLPROP1ENYL)PHENYL)CARBAMOYL)PHENYL)13DIOXOISOINDOLE5CARBOXYLICACID
22(5((4((1E)3OXO3PHENYLPROP1EN1YL)PHENYL)CARBAMOYL)BENZENE13DIYL)BIS(13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLICACID)
C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)O)N6C(=O)C7=C(C6=O)C=C(C=C7)C(=O)O
InChI=1SC40H23N3O10c4433(224213522)1582161126(12721)4134(45)251627(4235(46)2913923(39(50)51)1831(29)37(42)48)2028(1725)4336(47)30141024(40(52)53)1932(30)38(43)49h120H(H4145)(H5051)(H5253)b158+
MFCD00304527
O=C(c1cc(cc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O)Nc1ccc(cc1)C=CC(=O)c1ccccc1
STK072317
ZINC000008442430
ZINC8442430
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