Vitas-M small molecule compound
N-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}glycyl-D-isoleucine
Catalog ID
STL532797
SMILES CC[C@H]([C@H](C(=O)O)NC(=O)CNC(=O)COc1ccc2c(c1)oc(=O)cc2C)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 C20H24N2O7 MW 404.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O7/c1-4-11(2)19(20(26)27)22-16(23)9-21-17(24)10-28-13-5-6-14-12(3)7-18(25)29-15(14)8-13/h5-8,11,19H,4,9-10H2,1-3H3,(H,21,24)(H,22,23)(H,26,27)/t11-,19-/m1/s1InChIKey
SHHYSQQPBGNSEI-NSPYISDASA-NSynonyms
(2~(R)3~(R))3methyl2((2((2(4methyl2oxochromen7yl)oxyacetyl)amino)acetyl)amino)pentanoicacid
(2S3S)3methyl2(2(2((4methyl2oxo2Hchromen7yl)oxy)acetamido)acetamido)pentanoicacid
124358052
CC(C@@H)((C@@H)(C(=O)O)NC(=O)CNC(=O)COc1ccc2c(c1)oc(=O)cc2C)C
InChI=1SC20H24N2O7c1411(2)19(20(26)27)2216(23)92117(24)102813561412(3)718(25)2915(14)813h581119H4910H213H3(H2124)(H2223)(H2627)t1119m1s1
N(((4methyl2oxo2Hchromen7yl)oxy)acetyl)glycylDisoleucine
ZINC000015956229
ZINC15956229
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