Vitas-M small molecule compound
3-{[3-(4-hydroxyphenyl)-3-oxopropanoyl]amino}-4-[methyl(octadecyl)amino]benzoic acid
Catalog ID
STK367775
SMILES CCCCCCCCCCCCCCCCCCN(c1ccc(cc1NC(=O)CC(=O)c1ccc(cc1)O)C(=O)O)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 C35H52N2O5 MW 580.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H52N2O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-37(2)32-24-21-29(35(41)42)26-31(32)36-34(40)27-33(39)28-19-22-30(38)23-20-28/h19-24,26,38H,3-18,25,27H2,1-2H3,(H,36,40)(H,41,42)InChIKey
XPKWVKAFFLOITI-UHFFFAOYSA-NSynonyms
3((3(4hydroxyphenyl)3oxopropanoyl)amino)4(methyl(octadecyl)amino)benzoicacid
3(3(4HYDROXYPHENYL)3OXOPROPANOYLAMINO)4(METHYLOCTADECYLAMINO)BENZOICACID
CCCCCCCCCCCCCCCCCCN(C)C1=C(C=C(C=C1)C(=O)O)NC(=O)CC(=O)C2=CC=C(C=C2)O
InChI=1SC35H52N2O5c134567891011121314151617182537(2)32242129(35(41)42)2631(32)3634(40)2733(39)28192230(38)232028h19242638H3182527H212H3(H3640)(H4142)
MFCD00319230
ZINC000101812546
ZINC101812546
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