Vitas-M small molecule compound
methyl 4-[(3E)-3-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-4,5-dioxo-1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]benzoate
Catalog ID
STK614876
SMILES COC(=O)c1ccc(cc1)C1N(Cc2ccncc2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/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 C33H28N2O6 MW 548.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H28N2O6/c1-21-4-3-5-23(18-21)20-41-27-12-10-25(11-13-27)30(36)28-29(24-6-8-26(9-7-24)33(39)40-2)35(32(38)31(28)37)19-22-14-16-34-17-15-22/h3-18,29,36H,19-20H2,1-2H3/b30-28+InChIKey
YUIORIQHGXRWFU-SJCQXOIGSA-NSynonyms
836624-75-0836624750
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CC4=CC=NC=C4)C5=CC=C(C=C5)C(=O)OC)O
COC(=O)c1ccc(cc1)C1N(Cc2ccncc2)C(=O)C(=O)C1=C(c1ccc(cc1)OCc1cccc(c1)C)O
InChI=1SC33H28N2O6c12143523(1821)204127121025(111327)30(36)2829(246826(9724)33(39)402)35(32(38)31(28)37)1922141634171522h3182936H1920H212H3b3028+
methyl4((3E)3(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)45dioxo1(pyridin4ylmethyl)pyrrolidin2yl)benzoate
METHYL4((3E)3(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)45DIOXO1(PYRIDIN4YLMETHYL)PYRROLIDIN2YL)BENZOATE
MFCD08734368
ZINC000102713542
ZINC000102713544
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