Vitas-M small molecule compound
N-({[(2Z)-2-(4-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-D-alanine
Catalog ID
STL533027
SMILES COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N[C@@H](C(=O)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 C21H19NO7 MW 397.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO7/c1-12(21(25)26)22-19(23)11-28-15-7-8-16-17(10-15)29-18(20(16)24)9-13-3-5-14(27-2)6-4-13/h3-10,12H,11H2,1-2H3,(H,22,23)(H,25,26)/b18-9-/t12-/m1/s1InChIKey
XIXKUNFMOBBVFI-HALGXTDHSA-NSynonyms
956947-68-5(2~(R))2((2(((2~(Z))2((4methoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetyl)amino)propanoicacid
(RZ)2(2((2(4METHOXYBENZYLIDENE)3OXO23DIHYDROBENZOFURAN6YL)OXY)ACETAMIDO)PROPANOICACID
(SZ)2(2((2(4methoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetamido)propanoicacid
16404254
956947685
COc1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OCC(=O)N(C@H)(C(=O)O)C
InChI=1SC21H19NO7c112(21(25)26)2219(23)112815781617(1015)2918(20(16)24)9133514(272)6413h31012H11H212H3(H2223)(H2526)b189t12m1s1
N((((2Z)2(4methoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetyl)Dalanine
ZINC000012883365
ZINC12883365
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