Vitas-M small molecule compound
{[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetic acid
Catalog ID
STK925153
SMILES OC(=O)COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/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 C18H12O7 MW 340.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12O7/c19-17(20)8-22-11-2-3-12-14(7-11)25-16(18(12)21)6-10-1-4-13-15(5-10)24-9-23-13/h1-7H,8-9H2,(H,19,20)/b16-6-InChIKey
XZQNJJITEYYWAI-SOFYXZRVSA-NSynonyms
859130-31-7(((2Z)2(13benzodioxol5ylmethylidene)3oxo23dihydro1benzofuran6yl)oxy)aceticacid
(Z)2((2(BENZO(D)(13)DIOXOL5YLMETHYLENE)3OXO23DIHYDROBENZOFURAN6YL)OXY)ACETICACID
2(((2Z)2(13BENZODIOXOL5YLMETHYLIDENE)3OXO1BENZOFURAN6YL)OXY)ACETICACID
2(2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)3OXOBENZO(34B)FURAN6YLOXY)ACETICACID
859130317
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)C4=C(O3)C=C(C=C4)OCC(=O)O
InChI=1SC18H12O7c1917(20)82211231214(711)2516(18(12)21)610141315(510)2492313h17H89H2(H1920)b166
MFCD07637811
OC(=O)COc1ccc2c(c1)OC(=Cc1ccc3c(c1)OCO3)C2=O
ZINC000002126763
ZINC2126763
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