Vitas-M small molecule compound

(2S)-({[(4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}amino)(phenyl)ethanoic acid

Catalog ID
STL460588
SMILES CCc1cc(=O)oc2c1ccc(c2C)OCC(=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 C22H21NO6 MW 395.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO6/c1-3-14-11-19(25)29-21-13(2)17(10-9-16(14)21)28-12-18(24)23-20(22(26)27)15-7-5-4-6-8-15/h4-11,20H,3,12H2,1-2H3,(H,23,24)(H,26,27)/t20-/m0/s1
InChIKey
WTBPRYBJRCLLKP-FQEVSTJZSA-N
Synonyms
956045-00-4
(2S)((((4ethyl8methyl2oxo2Hchromen7yl)oxy)acetyl)amino)(phenyl)ethanoicacid
(2S)2((2(4ETHYL8METHYL2OXOCHROMEN7YL)OXYACETYL)AMINO)2PHENYLACETICACID
(S)2(2((4ethyl8methyl2oxo2Hchromen7yl)oxy)acetamido)2phenylaceticacid
956045004
CCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NC(C3=CC=CC=C3)C(=O)O
CCc1cc(=O)oc2c1ccc(c2C)OCC(=O)N(C@@H)(c1ccccc1)C(=O)O
InChI=1SC22H21NO6c13141119(25)292113(2)17(10916(14)21)281218(24)2320(22(26)27)157546815h41120H312H212H3(H2324)(H2627)t20m0s1
ZINC000002093572
ZINC2093572

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Available files

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