Vitas-M small molecule compound
N-({[(2Z)-2-(2,3-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-beta-alanine
Catalog ID
STL518017
SMILES COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)NCCC(=O)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 C22H21NO8 MW 427.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO8/c1-28-16-5-3-4-13(22(16)29-2)10-18-21(27)15-7-6-14(11-17(15)31-18)30-12-19(24)23-9-8-20(25)26/h3-7,10-11H,8-9,12H2,1-2H3,(H,23,24)(H,25,26)/b18-10-InChIKey
LZCQSVDNHPLMHK-ZDLGFXPLSA-NSynonyms
864761-69-3(Z)3(2((2(23DIMETHOXYBENZYLIDENE)3OXO23DIHYDROBENZOFURAN6YL)OXY)ACETAMIDO)PROPANOICACID
16404877
3((2(((2~(Z))2((23dimethoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetyl)amino)propanoicacid
864761693
COc1c(cccc1OC)C=C1Oc2c(C1=O)ccc(c2)OCC(=O)NCCC(=O)O
InChI=1SC22H21NO8c1281653413(22(16)292)101821(27)157614(1117(15)3118)301219(24)239820(25)26h371011H8912H212H3(H2324)(H2526)b1810
MFCD06768337
N((((2Z)2(23dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetyl)betaalanine
ZINC000012885385
ZINC12885385
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