Vitas-M small molecule compound

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

Catalog ID
STL541235
SMILES COc1ccc(cc1OC)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(13-6-9-15(28-2)16(10-13)29-3)22(20(25)19(17)24)14-7-4-12(5-8-14)21(26)27/h4-10,18,24H,1-3H3,(H,26,27)
InChIKey
PDMQOJQHAOIIAI-UHFFFAOYSA-N
Synonyms
858742-21-9
3825818
4(3acetyl2(34dimethoxyphenyl)4hydroxy5oxo2~(H)pyrrol1yl)benzoicacid
4(3acetyl2(34dimethoxyphenyl)4hydroxy5oxo25dihydro1Hpyrrol1yl)benzoicacid
4(3ACETYL2(34DIMETHOXYPHENYL)4HYDROXY5OXO2HPYRROL1YL)BENZOICACID
858742219
InChI=1SC21H19NO7c111(23)1718(136915(282)16(1013)293)22(20(25)19(17)24)147412(5814)21(26)27h4101824H13H3(H2627)
MFCD02158678
ZINC000018085002
ZINC000020113525

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Available files

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