Vitas-M small molecule compound
3-({[2-(3-hydroxy-3-methylbut-1-yn-1-yl)phenyl]carbonyl}amino)-3-phenylpropanoic acid
Catalog ID
STK185387
SMILES OC(=O)CC(c1ccccc1)NC(=O)c1ccccc1C#CC(O)(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 C21H21NO4 MW 351.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4/c1-21(2,26)13-12-15-8-6-7-11-17(15)20(25)22-18(14-19(23)24)16-9-4-3-5-10-16/h3-11,18,26H,14H2,1-2H3,(H,22,25)(H,23,24)InChIKey
MVPFLELHOXSKAD-UHFFFAOYSA-NSynonyms
(3R)3((2(3HYDROXY3METHYLBUT1YN1YL)BENZOYL)AMINO)3PHENYLPROPANOICACID
3(((2(3HYDROXY3METHYLBUT1YN1YL)PHENYL)CARBONYL)AMINO)3PHENYLPROPANOICACID
3((2(3HYDROXY3METHYLBUT1YNYL)BENZOYL)AMINO)3PHENYLPROPANOICACID
CC(C)(C#CC1=CC=CC=C1C(=O)NC(CC(=O)O)C2=CC=CC=C2)O
InChI=1SC21H21NO4c121(226)1312158671117(15)20(25)2218(1419(23)24)1694351016h3111826H14H212H3(H2225)(H2324)
MFCD05856079
ZINC000004697997
ZINC000004697998
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