Vitas-M small molecule compound
4-[4-hydroxy-1-(3-methoxybenzyl)-3-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoic acid
Catalog ID
STK884960
SMILES COc1cccc(c1)CN1C(c2ccc(cc2)C(=O)O)C(=C(C1=O)O)c1ccc(cc1)C
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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 C26H23NO5 MW 429.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO5/c1-16-6-8-18(9-7-16)22-23(19-10-12-20(13-11-19)26(30)31)27(25(29)24(22)28)15-17-4-3-5-21(14-17)32-2/h3-14,23,28H,15H2,1-2H3,(H,30,31)InChIKey
PKGCAIZHCQOILC-UHFFFAOYSA-NSynonyms
4(4hydroxy1((3methoxyphenyl)methyl)3(4methylphenyl)5oxo2Hpyrrol2yl)benzoicacid
4(4hydroxy1(3methoxybenzyl)3(4methylphenyl)5oxo25dihydro1Hpyrrol2yl)benzoicacid
CC1=CC=C(C=C1)C2=C(C(=O)N(C2C3=CC=C(C=C3)C(=O)O)CC4=CC(=CC=C4)OC)O
InChI=1SC26H23NO5c1166818(9716)2223(19101220(131119)26(30)31)27(25(29)24(22)28)151743521(1417)322h3142328H15H212H3(H3031)
MFCD18171843
ZINC000040485630
ZINC000040485633
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