Vitas-M small molecule compound
(2S)-{[(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]amino}(phenyl)ethanoic acid
Catalog ID
STL462745
SMILES COc1cc2c(cc1OC)oc(=O)c(c2C)CC(=O)N[C@@H](c1ccccc1)C(=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 C22H21NO7 MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO7/c1-12-14-9-17(28-2)18(29-3)11-16(14)30-22(27)15(12)10-19(24)23-20(21(25)26)13-7-5-4-6-8-13/h4-9,11,20H,10H2,1-3H3,(H,23,24)(H,25,26)/t20-/m0/s1InChIKey
JPXQHLGJCXEXLG-FQEVSTJZSA-NSynonyms
956691-23-9(2S)(((67dimethoxy4methyl2oxo2Hchromen3yl)acetyl)amino)(phenyl)ethanoicacid
(2S)2((2(67DIMETHOXY4METHYL2OXOCHROMEN3YL)ACETYL)AMINO)2PHENYLACETICACID
(S)2(2(67dimethoxy4methyl2oxo2Hchromen3yl)acetamido)2phenylaceticacid
956691239
CC1=C(C(=O)OC2=CC(=C(C=C12)OC)OC)CC(=O)NC(C3=CC=CC=C3)C(=O)O
COc1cc2c(cc1OC)oc(=O)c(c2C)CC(=O)N(C@@H)(c1ccccc1)C(=O)O
InChI=1SC22H21NO7c11214917(282)18(293)1116(14)3022(27)15(12)1019(24)2320(21(25)26)137546813h491120H10H213H3(H2324)(H2526)t20m0s1
ZINC000002124813
ZINC2124813
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