Vitas-M small molecule compound

4-[3-acetyl-2-(2,4-dimethoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoic acid

Catalog ID
STL542212
SMILES COc1ccc(c(c1)OC)C1C(=C(C(=O)N1c1ccc(cc1)C(=O)O)O)C(=O)C

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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 C21H19NO7 MW 397.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO7/c1-11(23)17-18(15-9-8-14(28-2)10-16(15)29-3)22(20(25)19(17)24)13-6-4-12(5-7-13)21(26)27/h4-10,18,24H,1-3H3,(H,26,27)
InChIKey
XOQUMJXCABZEBS-UHFFFAOYSA-N
Synonyms
858743-36-9
3798113
4(3acetyl2(24dimethoxyphenyl)4hydroxy5oxo2~(H)pyrrol1yl)benzoicacid
4(3acetyl2(24dimethoxyphenyl)4hydroxy5oxo25dihydro1Hpyrrol1yl)benzoicacid
4(3ACETYL2(24DIMETHOXYPHENYL)4HYDROXY5OXO2HPYRROL1YL)BENZOICACID
858743369
InChI=1SC21H19NO7c111(23)1718(159814(282)1016(15)293)22(20(25)19(17)24)136412(5713)21(26)27h4101824H13H3(H2627)
MFCD02158677
ZINC000018099103
ZINC000018128995

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Available files

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