Vitas-M small molecule compound
4-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}-3-phenylbutanoic acid
Catalog ID
STL534662
SMILES COc1cc(/C=C/C(=O)NCC(c2ccccc2)CC(=O)O)ccc1O
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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 C20H21NO5 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5/c1-26-18-11-14(7-9-17(18)22)8-10-19(23)21-13-16(12-20(24)25)15-5-3-2-4-6-15/h2-11,16,22H,12-13H2,1H3,(H,21,23)(H,24,25)/b10-8+InChIKey
INIMXTMRPDDBBA-CSKARUKUSA-NSynonyms
904261-47-8(E)4(3(4hydroxy3methoxyphenyl)acrylamido)3phenylbutanoicacid
16406445
4(((~(E))3(4hydroxy3methoxyphenyl)prop2enoyl)amino)3phenylbutanoicacid
4(((2E)3(4hydroxy3methoxyphenyl)prop2enoyl)amino)3phenylbutanoicacid
904261478
COc1cc(C=CC(=O)NCC(c2ccccc2)CC(=O)O)ccc1O
InChI=1SC20H21NO5c126181114(7917(18)22)81019(23)211316(1220(24)25)155324615h2111622H1213H21H3(H2123)(H2425)b108+
MFCD07637723
ZINC000004090803
ZINC000004090806
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