Vitas-M small molecule compound
methyl (2Z)-2-(4-hydroxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Catalog ID
STK516477
SMILES COC(=O)c1ccc2c(c1)C(=O)/C(=C/c1ccc(cc1)O)/O2
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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 C17H12O5 MW 296.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12O5/c1-21-17(20)11-4-7-14-13(9-11)16(19)15(22-14)8-10-2-5-12(18)6-3-10/h2-9,18H,1H3/b15-8-InChIKey
PTQFQYKDIQOOMX-NVNXTCNLSA-NSynonyms
(2Z)2((4HYDROXYPHENYL)METHYLIDENE)3OXO5BENZOFURANCARBOXYLICACIDMETHYLESTER
(2Z)2(4HYDROXYBENZYLIDENE)3KETOCOUMARAN5CARBOXYLICACIDMETHYLESTER
COC(=O)C1=CC2=C(C=C1)OC(=CC3=CC=C(C=C3)O)C2=O
COC(=O)c1ccc2c(c1)C(=O)C(=Cc1ccc(cc1)O)O2
InChI=1SC17H12O5c12117(20)11471413(911)16(19)15(2214)8102512(18)6310h2918H1H3b158
METHYL(2Z)2((4HYDROXYPHENYL)METHYLIDENE)3OXIDANYLIDENE1BENZOFURAN5CARBOXYLATE
METHYL(2Z)2((4HYDROXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN5CARBOXYLATE
methyl(2Z)2(4hydroxybenzylidene)3oxo23dihydro1benzofuran5carboxylate
METHYL2((4HYDROXYPHENYL)METHYLENE)3OXOBENZO(B)FURAN5CARBOXYLATE
MFCD06645669
ZINC000005047777
ZINC05047777
ZINC5047777
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