Vitas-M small molecule compound
2-{[N-(furan-2-ylmethyl)-alpha-aspartyl]amino}benzoic acid
Catalog ID
STK354947
SMILES OC(=O)CC(C(=O)Nc1ccccc1C(=O)O)NCc1ccco1
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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 C16H16N2O6 MW 332.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O6/c19-14(20)8-13(17-9-10-4-3-7-24-10)15(21)18-12-6-2-1-5-11(12)16(22)23/h1-7,13,17H,8-9H2,(H,18,21)(H,19,20)(H,22,23)InChIKey
CBZIBEWXUFRPOZ-UHFFFAOYSA-NSynonyms
1214122-08-31214122083
2((2(FURAN2YLMETHYLAMINO)4HYDROXY4OXOBUTANOYL)AMINO)BENZOICACID
2((3carboxy2(furan2ylmethylamino)propanoyl)amino)benzoicacid
2((N(FURAN2YLMETHYL)ALPHAASPARTYL)AMINO)BENZOICACID
C1=CC=C(C(=C1)C(=O)O)NC(=O)C(CC(=O)O)NCC2=CC=CO2
InChI=1SC16H16N2O6c1914(20)813(179104372410)15(21)1812621511(12)16(22)23h171317H89H2(H1821)(H1920)(H2223)
MFCD10465796
ZINC000009957044
ZINC000009957048
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