Vitas-M small molecule compound
methyl (5Z)-5-(4-hydroxybenzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160094
SMILES COC(=O)C1=C(C)N/C(=C\c2ccc(cc2)O)/C1=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 C14H13NO4 MW 259.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13NO4/c1-8-12(14(18)19-2)13(17)11(15-8)7-9-3-5-10(16)6-4-9/h3-7,15-16H,1-2H3/b11-7-InChIKey
HRAPEJJHIPXRJD-XFFZJAGNSA-NSynonyms
CC1=C(C(=O)C(=CC2=CC=C(C=C2)O)N1)C(=O)OC
COC(=O)C1=C(C)NC(=Cc2ccc(cc2)O)C1=O
InChI=1SC14H13NO4c1812(14(18)192)13(17)11(158)793510(16)649h371516H12H3b117
METHYL(5Z)5((4HYDROXYPHENYL)METHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
METHYL(5Z)5(4HYDROXYBENZYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01988433
ZINC000018167368
ZINC18167368
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