Vitas-M small molecule compound

(S)-3-hydroxy-2-((2S,3S)-2-(3-hydroxy-1,2-dihydroquinoxaline-1-carboxamido)-3-methylpentanamido)propanoic acid

Catalog ID
STL530598
SMILES CCC([C@@H](C(=O)N[C@H](C(=O)O)CO)NC(=O)N1CC(=Nc2c1cccc2)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 C18H24N4O6 MW 392.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N4O6/c1-3-10(2)15(16(25)20-12(9-23)17(26)27)21-18(28)22-8-14(24)19-11-6-4-5-7-13(11)22/h4-7,10,12,15,23H,3,8-9H2,1-2H3,(H,19,24)(H,20,25)(H,21,28)(H,26,27)/t10?,12-,15-/m0/s1
InChIKey
CBAMZYHLLIRXIF-QKHYJBKJSA-N
Synonyms
956915-80-3
(2~(S))3hydroxy2(((2~(S))3methyl2((3oxo24dihydroquinoxaline1carbonyl)amino)pentanoyl)amino)propanoicacid
16406383
956915803
InChI=1SC18H24N4O6c1310(2)15(16(25)2012(923)17(26)27)2118(28)22814(24)1911645713(11)22h4710121523H389H212H3(H1924)(H2025)(H2128)(H2627)t10?1215m0s1
MFCD07796914
ZINC000008994206
ZINC000012889572

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.