Vitas-M small molecule compound
3-[(4-phenylbutanoyl)amino]-3-[4-(propan-2-yloxy)phenyl]propanoic acid
Catalog ID
STK680311
SMILES O=C(NC(c1ccc(cc1)OC(C)C)CC(=O)O)CCCc1ccccc1
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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 C22H27NO4 MW 369.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4/c1-16(2)27-19-13-11-18(12-14-19)20(15-22(25)26)23-21(24)10-6-9-17-7-4-3-5-8-17/h3-5,7-8,11-14,16,20H,6,9-10,15H2,1-2H3,(H,23,24)(H,25,26)InChIKey
AYDTVZATYCOWPA-UHFFFAOYSA-NSynonyms
3((4phenylbutanoyl)amino)3(4(propan2yloxy)phenyl)propanoicacid
3(4PHENYLBUTANOYLAMINO)3(4PROPAN2YLOXYPHENYL)PROPANOICACID
CC(C)OC1=CC=C(C=C1)C(CC(=O)O)NC(=O)CCCC2=CC=CC=C2
InChI=1SC22H27NO4c116(2)2719131118(121419)20(1522(25)26)2321(24)1069177435817h357811141620H691015H212H3(H2324)(H2526)
MFCD03767151
ZINC000003623820
ZINC000003623822
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