Vitas-M small molecule compound
3-[1-(2-carboxyethyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(2,4-dihydroxy-6-methylpyridin-3-yl)propanoic acid
Catalog ID
STL313732
SMILES OC(=O)CC(c1c(O)cc(nc1O)C)c1c(C)nn(c1C)CCC(=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 C17H21N3O6 MW 363.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O6/c1-8-6-12(21)16(17(26)18-8)11(7-14(24)25)15-9(2)19-20(10(15)3)5-4-13(22)23/h6,11H,4-5,7H2,1-3H3,(H,22,23)(H,24,25)(H2,18,21,26)InChIKey
AVEABIPJUMTBLB-UHFFFAOYSA-NSynonyms
1442079-90-41442079904
3(1(2carboxyethyl)35dimethyl1Hpyrazol4yl)3(24dihydroxy6methylpyridin3yl)propanoicacid
3(1(2carboxyethyl)35dimethylpyrazol4yl)3(4hydroxy6methyl2oxo1Hpyridin3yl)propanoicacid
CC1=CC(=C(C(=O)N1)C(CC(=O)O)C2=C(N(N=C2C)CCC(=O)O)C)O
InChI=1SC17H21N3O6c18612(21)16(17(26)188)11(714(24)25)159(2)1920(10(15)3)5413(22)23h611H457H213H3(H2223)(H2425)(H2182126)
MFCD28030286
ZINC000095475798
ZINC000095475799
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