Vitas-M small molecule compound

5-hydroxy-7-(4-hydroxyphenyl)-1-(3-methoxyphenyl)-6,7-dihydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid

Catalog ID
STL536294
SMILES COc1cccc(c1)n1cc(c2c1C(CC(=N2)O)c1ccc(cc1)O)C(=O)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 C21H18N2O5 MW 378.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O5/c1-28-15-4-2-3-13(9-15)23-11-17(21(26)27)19-20(23)16(10-18(25)22-19)12-5-7-14(24)8-6-12/h2-9,11,16,24H,10H2,1H3,(H,22,25)(H,26,27)
InChIKey
GNHYWXZGYLHBTP-UHFFFAOYSA-N
Synonyms
1234924-31-2
1234924312
51052232
5hydroxy7(4hydroxyphenyl)1(3methoxyphenyl)67dihydro1Hpyrrolo(32b)pyridine3carboxylicacid
7(4hydroxyphenyl)1(3methoxyphenyl)5oxo67dihydro4~(H)pyrrolo(32b)pyridine3carboxylicacid
InChI=1SC21H18N2O5c1281542313(915)231117(21(26)27)1920(23)16(1018(25)2219)125714(24)8612h29111624H10H21H3(H2225)(H2627)
MFCD31754411
ZINC000049543431
ZINC000049543433

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Available files

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