Vitas-M small molecule compound
(E)-[4-(benzyloxy)-2-methylphenyl][2-(4-methylphenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Catalog ID
STK564620
SMILES Cc1ccc(cc1)C1N(Cc2ccc[nH+]c2)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[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 C32H28N2O4 MW 504.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N2O4/c1-21-10-12-25(13-11-21)29-28(31(36)32(37)34(29)19-24-9-6-16-33-18-24)30(35)27-15-14-26(17-22(27)2)38-20-23-7-4-3-5-8-23/h3-18,29,35H,19-20H2,1-2H3/b30-28+InChIKey
UDKJCZVYNRDHFY-SJCQXOIGSA-NSynonyms
487025-74-1(4E)4(HYDROXY(2METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)5(4METHYLPHENYL)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(4METHYLPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(2METHYL4PHENYLMETHOXYPHENYL)METHANOLATE
(E)(4(benzyloxy)2methylphenyl)(2(4methylphenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)methanolate
487025741
CC1=CC=C(C=C1)C2C(=C(C3=C(C=C(C=C3)OCC4=CC=CC=C4)C)O)C(=O)C(=O)N2CC5=CN=CC=C5
Cc1ccc(cc1)C1N(Cc2ccc(nH+)c2)C(=O)C(=O)C1=C(c1ccc(cc1C)OCc1ccccc1)(O)
InChI=1SC32H28N2O4c121101225(131121)2928(31(36)32(37)34(29)19249616331824)30(35)27151426(1722(27)2)3820237435823h3182935H1920H212H3b3028+
MFCD18244578
ZINC000102529011
ZINC000102529019
Check stock
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Check stock on Vitas-MAvailable files
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