Vitas-M small molecule compound
2-({[(1S)-1-carboxy-2-methylpropyl]carbamoyl}amino)benzoic acid
Catalog ID
STL458104
SMILES O=C(Nc1ccccc1C(=O)O)N[C@H](C(=O)O)C(C)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 C13H16N2O5 MW 280.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O5/c1-7(2)10(12(18)19)15-13(20)14-9-6-4-3-5-8(9)11(16)17/h3-7,10H,1-2H3,(H,16,17)(H,18,19)(H2,14,15,20)/t10-/m0/s1InChIKey
OAASKAREXXLWCM-JTQLQIEISA-NSynonyms
955972-31-3(S)2(3(1carboxy2methylpropyl)ureido)benzoicacid
2((((1S)1carboxy2methylpropyl)carbamoyl)amino)benzoicacid
2(((1S)1carboxy2methylpropyl)carbamoylamino)benzoicacid
2(((2S)1HYDROXY3METHYL1OXOBUTAN2YL)CARBAMOYLAMINO)BENZOICACID
955972313
CC(C)C(C(=O)O)NC(=O)NC1=CC=CC=C1C(=O)O
InChI=1SC13H16N2O5c17(2)10(12(18)19)1513(20)14964358(9)11(16)17h3710H12H3(H1617)(H1819)(H2141520)t10m0s1
O=C(Nc1ccccc1C(=O)O)N(C@H)(C(=O)O)C(C)C
ZINC000004061910
ZINC4061910
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