Vitas-M small molecule compound
{[(2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetic acid
Catalog ID
STL033483
SMILES COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCC(=O)O)cc(c1OC)OC
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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 C20H18O8 MW 386.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18O8/c1-24-16-7-11(8-17(25-2)20(16)26-3)6-15-19(23)13-5-4-12(9-14(13)28-15)27-10-18(21)22/h4-9H,10H2,1-3H3,(H,21,22)/b15-6-InChIKey
BLCUCBSJNHGPDF-UUASQNMZSA-NSynonyms
859662-11-6(((2Z)3oxo2(345trimethoxybenzylidene)23dihydro1benzofuran6yl)oxy)aceticacid
(Z)2((3OXO2(345TRIMETHOXYBENZYLIDENE)23DIHYDROBENZOFURAN6YL)OXY)ACETICACID
2(((2Z)3OXO2((345TRIMETHOXYPHENYL)METHYLIDENE)1BENZOFURAN6YL)OXY)ACETICACID
2(3OXO2((345TRIMETHOXYPHENYL)METHYLENE)BENZO(34B)FURAN6YLOXY)ACETICACID
859662116
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)O
COc1cc(C=C2Oc3c(C2=O)ccc(c3)OCC(=O)O)cc(c1OC)OC
InChI=1SC20H18O8c12416711(817(252)20(16)263)61519(23)135412(914(13)2815)271018(21)22h49H10H213H3(H2122)b156
MFCD06407609
ZINC000012890159
ZINC12890159
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