Vitas-M small molecule compound
4-{[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STL228044
SMILES OCC(C(c1ccc(cc1)[N+](=O)[O-])O)NC(=O)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 C13H16N2O7 MW 312.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O7/c16-7-10(14-11(17)5-6-12(18)19)13(20)8-1-3-9(4-2-8)15(21)22/h1-4,10,13,16,20H,5-7H2,(H,14,17)(H,18,19)InChIKey
VFAMVSYUKUIFGL-UHFFFAOYSA-NSynonyms
96053-93-94((13dihydroxy1(4nitrophenyl)propan2yl)amino)4oxobutanoicacid
96053939
C1=CC(=CC=C1C(C(CO)NC(=O)CCC(=O)O)O)(N+)(=O)(O)
InChI=1SC13H16N2O7c16710(1411(17)5612(18)19)13(20)8139(428)15(21)22h1410131620H57H2(H1417)(H1819)
MFCD04420131
OCC(C(c1ccc(cc1)(N+)(=O)(O))O)NC(=O)CCC(=O)O
ZINC000002697414
ZINC000002697419
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