Vitas-M small molecule compound
2-[(4-carboxy-3-methylbutanoyl)amino]benzoic acid
Catalog ID
STK975586
SMILES OC(=O)CC(CC(=O)Nc1ccccc1C(=O)O)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 C13H15NO5 MW 265.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15NO5/c1-8(7-12(16)17)6-11(15)14-10-5-3-2-4-9(10)13(18)19/h2-5,8H,6-7H2,1H3,(H,14,15)(H,16,17)(H,18,19)InChIKey
BFXAOFUBLOCORQ-UHFFFAOYSA-NSynonyms
692278-69-62((4carboxy3methylbutanoyl)amino)benzoicacid
2((5HYDROXY3METHYL5OXOPENTANOYL)AMINO)BENZOICACID
2(4carboxy3methylbutanamido)benzoicacid
692278696
CC(CC(=O)NC1=CC=CC=C1C(=O)O)CC(=O)O
InChI=1SC13H15NO5c18(712(16)17)611(15)141053249(10)13(18)19h258H67H21H3(H1415)(H1617)(H1819)
MFCD03502631
ZINC000000206520
ZINC000000206521
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