Vitas-M small molecule compound
methyl 4-[4-hydroxy-1-(4-methoxybenzyl)-3-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
Catalog ID
STK884958
SMILES COc1ccc(cc1)CN1C(c2ccc(cc2)C(=O)OC)C(=C(C1=O)O)c1ccc(cc1)OC
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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 C27H25NO6 MW 459.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO6/c1-32-21-12-4-17(5-13-21)16-28-24(19-6-8-20(9-7-19)27(31)34-3)23(25(29)26(28)30)18-10-14-22(33-2)15-11-18/h4-15,24,29H,16H2,1-3H3InChIKey
ULQXIAUNPJTZCQ-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)CN2C(C(=C(C2=O)O)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)C(=O)OC
InChI=1SC27H25NO6c1322112417(51321)162824(196820(9719)27(31)343)23(25(29)26(28)30)18101422(332)151118h4152429H16H213H3
methyl4(4hydroxy1(4methoxybenzyl)3(4methoxyphenyl)5oxo25dihydro1Hpyrrol2yl)benzoate
methyl4(4hydroxy3(4methoxyphenyl)1((4methoxyphenyl)methyl)5oxo2Hpyrrol2yl)benzoate
MFCD18171841
ZINC000040485620
ZINC000040485622
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