Vitas-M small molecule compound

methyl 5-[3-amino-1-(4-methoxynaphthalen-1-yl)-3-oxopropyl]-4,6-dihydroxypyridine-3-carboxylate

Catalog ID
STL547866
SMILES COC(=O)c1cnc(c(c1O)C(c1ccc(c2c1cccc2)OC)CC(=O)N)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 C21H20N2O6 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O6/c1-28-16-8-7-12(11-5-3-4-6-13(11)16)14(9-17(22)24)18-19(25)15(21(27)29-2)10-23-20(18)26/h3-8,10,14H,9H2,1-2H3,(H2,22,24)(H2,23,25,26)
InChIKey
GEFDVNYONPJYBO-UHFFFAOYSA-N
Synonyms

110207261
InChI=1SC21H20N2O6c128168712(11534613(11)16)14(917(22)24)1819(25)15(21(27)292)102320(18)26h381014H9H212H3(H22224)(H2232526)
methyl5(3amino1(4methoxynaphthalen1yl)3oxopropyl)46dihydroxypyridine3carboxylate
methyl5(3amino1(4methoxynaphthalen1yl)3oxopropyl)4hydroxy6oxo1~(H)pyridine3carboxylate
METHYL5(3AMINO1(4METHOXYNAPHTHALEN1YL)3OXOPROPYL)4HYDROXY6OXO16DIHYDROPYRIDINE3CARBOXYLATE
MFCD31756654
ZINC000253623681
ZINC000253623682

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Available files

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