Vitas-M small molecule compound
methyl 3-[5-(4-acetylphenyl)furan-2-yl]-3-[(2Z)-6-hydroxy-2-(morpholin-4-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-7-yl]propanoate
Catalog ID
STL549429
SMILES COC(=O)CC(c1c(O)ccc2c1O/C(=C\N1CCOCC1)/C2=O)c1ccc(o1)c1ccc(cc1)C(=O)C
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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 C29H27NO8 MW 517.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO8/c1-17(31)18-3-5-19(6-4-18)23-9-10-24(37-23)21(15-26(33)35-2)27-22(32)8-7-20-28(34)25(38-29(20)27)16-30-11-13-36-14-12-30/h3-10,16,21,32H,11-15H2,1-2H3/b25-16-InChIKey
DOWUVKBZIHEVCE-XYGWBWBKSA-NSynonyms
(Z)methyl3(5(4acetylphenyl)furan2yl)3(6hydroxy2(morpholinomethylene)3oxo23dihydrobenzofuran7yl)propanoate
127252721
COC(=O)CC(c1c(O)ccc2c1OC(=CN1CCOCC1)C2=O)c1ccc(o1)c1ccc(cc1)C(=O)C
InChI=1SC29H27NO8c117(31)183519(6418)2391024(3723)21(1526(33)352)2722(32)872028(34)25(3829(20)27)1630111336141230h310162132H1115H212H3b2516
methyl3(5(4acetylphenyl)furan2yl)3((2~(Z))6hydroxy2(morpholin4ylmethylidene)3oxo1benzofuran7yl)propanoate
methyl3(5(4acetylphenyl)furan2yl)3((2Z)6hydroxy2(morpholin4ylmethylidene)3oxo23dihydro1benzofuran7yl)propanoate
MFCD31756985
ZINC000604404171
ZINC001081803838
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