Vitas-M small molecule compound
(2Z)-2-[(2-methyl-2H-chromen-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methoxybenzoate
Catalog ID
STL033258
SMILES COc1ccc(cc1)C(=O)Oc1ccc2c(c1)O/C(=C\C1=Cc3ccccc3OC1C)/C2=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 C27H20O6 MW 440.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20O6/c1-16-19(13-18-5-3-4-6-23(18)31-16)14-25-26(28)22-12-11-21(15-24(22)33-25)32-27(29)17-7-9-20(30-2)10-8-17/h3-16H,1-2H3/b25-14-InChIKey
JFDAJWXBYOTKBR-QFEZKATASA-NSynonyms
859664-38-3((2Z)2((2methyl2Hchromen3yl)methylidene)3oxo1benzofuran6yl)4methoxybenzoate
(2Z)2((2methyl2Hchromen3yl)methylidene)3oxo23dihydro1benzofuran6yl4methoxybenzoate
(Z)2((2methyl2Hchromen3yl)methylene)3oxo23dihydrobenzofuran6yl4methoxybenzoate
2((2METHYL(2HCHROMEN3YL))METHYLENE)3OXOBENZO(34B)FURAN6YL4METHOXYBENZOATE
859664383
CC1C(=CC2=CC=CC=C2O1)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5=CC=C(C=C5)OC
COc1ccc(cc1)C(=O)Oc1ccc2c(c1)OC(=CC1=Cc3ccccc3OC1C)C2=O
InChI=1SC27H20O6c11619(1318534623(18)3116)142526(28)22121121(1524(22)3325)3227(29)177920(302)10817h316H12H3b2514
MFCD06494920
ZINC000002133402
ZINC000002133406
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