Vitas-M small molecule compound
4-[(1E)-3-(2,4-dimethoxyphenyl)-3-oxoprop-1-en-1-yl]benzoic acid
Catalog ID
STK626444
SMILES COc1ccc(c(c1)OC)C(=O)/C=C/c1ccc(cc1)C(=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 C18H16O5 MW 312.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16O5/c1-22-14-8-9-15(17(11-14)23-2)16(19)10-5-12-3-6-13(7-4-12)18(20)21/h3-11H,1-2H3,(H,20,21)/b10-5+InChIKey
ZGOJJBQEAOMRNO-BJMVGYQFSA-NSynonyms
637748-03-9(E)4(3(24dimethoxyphenyl)3oxoprop1en1yl)benzoicacid
4((1E)3(24dimethoxyphenyl)3oxoprop1en1yl)benzoicacid
4((E)3(24DIMETHOXYPHENYL)3OXOPROP1ENYL)BENZOICACID
637748039
COC1=CC(=C(C=C1)C(=O)C=CC2=CC=C(C=C2)C(=O)O)OC
COc1ccc(c(c1)OC)C(=O)C=Cc1ccc(cc1)C(=O)O
InChI=1SC18H16O5c122148915(17(1114)232)16(19)105123613(7412)18(20)21h311H12H3(H2021)b105+
MFCD03853699
ZINC000005400086
ZINC5400086
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