Vitas-M small molecule compound
4-{[1-(2,3-dimethylphenyl)-3-methoxy-3-oxopropyl]amino}-4-oxobutanoic acid
Catalog ID
STK017730
SMILES COC(=O)CC(c1cccc(c1C)C)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 C16H21NO5 MW 307.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO5/c1-10-5-4-6-12(11(10)2)13(9-16(21)22-3)17-14(18)7-8-15(19)20/h4-6,13H,7-9H2,1-3H3,(H,17,18)(H,19,20)InChIKey
UCKCIUYMKDDAOX-UHFFFAOYSA-NSynonyms
4((1(23DIMETHYLPHENYL)3METHOXY3OXOPROPYL)AMINO)4OXOBUTANOICACID
CC1=C(C(=CC=C1)C(CC(=O)OC)NC(=O)CCC(=O)O)C
COC(=O)CC(c1cccc(c1C)C)NC(=O)CCC(=O)O
InChI=1SC16H21NO5c11054612(11(10)2)13(916(21)223)1714(18)7815(19)20h4613H79H213H3(H1718)(H1920)
MFCD08049705
STK017730
ZINC000004576197
ZINC000004576198
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