Vitas-M small molecule compound
4-[(1E)-3-oxo-3-(3,4,5-trimethoxyphenyl)prop-1-en-1-yl]benzoic acid
Catalog ID
STK922368
SMILES COc1cc(cc(c1OC)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 C19H18O6 MW 342.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18O6/c1-23-16-10-14(11-17(24-2)18(16)25-3)15(20)9-6-12-4-7-13(8-5-12)19(21)22/h4-11H,1-3H3,(H,21,22)/b9-6+InChIKey
QSFJHQPTHBCRMP-RMKNXTFCSA-NSynonyms
797004-81-04((1E)3oxo3(345trimethoxyphenyl)prop1en1yl)benzoicacid
4((1E)3OXO3(345TRIMETHOXYPHENYL)PROP1ENYL)BENZOICACID
4((E)3OXO3(345TRIMETHOXYPHENYL)PROP1ENYL)BENZOICACID
797004810
COC1=CC(=CC(=C1OC)OC)C(=O)C=CC2=CC=C(C=C2)C(=O)O
COc1cc(cc(c1OC)OC)C(=O)C=Cc1ccc(cc1)C(=O)O
InChI=1SC19H18O6c123161014(1117(242)18(16)253)15(20)96124713(8512)19(21)22h411H13H3(H2122)b96+
MFCD04745316
ZINC000006639939
ZINC6639939
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