Vitas-M small molecule compound

methyl (4Z)-1-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4-(3,4,5-trimethoxybenzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK161459
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(OC)c(c(c1)OC)OC)c1ccc(c(c1)OC)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 C25H27NO8 MW 469.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO8/c1-14-22(25(28)34-7)17(10-15-11-20(31-4)23(33-6)21(12-15)32-5)24(27)26(14)16-8-9-18(29-2)19(13-16)30-3/h8-13H,1-7H3/b17-10-
InChIKey
JQNDWBAYCSUINA-YVLHZVERSA-N
Synonyms

CC1=C(C(=CC2=CC(=C(C(=C2)OC)OC)OC)C(=O)N1C3=CC(=C(C=C3)OC)OC)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1cc(OC)c(c(c1)OC)OC)c1ccc(c(c1)OC)OC
InChI=1SC25H27NO8c11422(25(28)347)17(10151120(314)23(336)21(1215)325)24(27)26(14)168918(292)19(1316)303h813H17H3b1710
METHYL(4Z)1(34DIMETHOXYPHENYL)2METHYL5OXO4((345TRIMETHOXYPHENYL)METHYLIDENE)PYRROLE3CARBOXYLATE
METHYL(4Z)1(34DIMETHOXYPHENYL)2METHYL5OXO4(345TRIMETHOXYBENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL1(34DIMETHOXYPHENYL)5METHYL2OXO3((345TRIMETHOXYPHENYL)METHYLENE)AZOLINE4CARBOXYLATE
MFCD03252719
ZINC000008872611
ZINC08872611
ZINC8872611

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.