Vitas-M small molecule compound
3-[(4-carboxy-3-phenylbutanoyl)amino]benzoic acid
Catalog ID
STL346259
SMILES O=C(CC(c1ccccc1)CC(=O)O)Nc1cccc(c1)C(=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 C18H17NO5 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO5/c20-16(19-15-8-4-7-13(9-15)18(23)24)10-14(11-17(21)22)12-5-2-1-3-6-12/h1-9,14H,10-11H2,(H,19,20)(H,21,22)(H,23,24)InChIKey
VWMXBHHKVFZRBW-UHFFFAOYSA-NSynonyms
848755-51-13((4carboxy3phenylbutanoyl)amino)benzoicacid
3((5HYDROXY5OXO3PHENYLPENTANOYL)AMINO)BENZOICACID
3(4carboxy3phenylbutanamido)benzoicacid
848755511
C1=CC=C(C=C1)C(CC(=O)NC2=CC=CC(=C2)C(=O)O)CC(=O)O
InChI=1SC18H17NO5c2016(191584713(915)18(23)24)1014(1117(21)22)125213612h1914H1011H2(H1920)(H2122)(H2324)
MFCD04196872
ZINC000000546217
ZINC000000546218
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