Vitas-M small molecule compound
2-[2-carboxy-1-(2-hydroxyquinolin-3-yl)ethyl]-3-hydroxy-1,4,5-trimethyl-1H-imidazol-3-ium
Catalog ID
STL553512
SMILES OC(=O)CC(c1[n+](O)c(c(n1C)C)C)c1cc2ccccc2nc1O
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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 C18H20N3O4 MW 342.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4/c1-10-11(2)21(25)18(20(10)3)14(9-16(22)23)13-8-12-6-4-5-7-15(12)19-17(13)24/h4-8,14H,9H2,1-3H3,(H2-,19,22,23,24,25)/p+1InChIKey
NXISOZOJGIIOQQ-UHFFFAOYSA-OSynonyms
127252887
2(2carboxy1(2hydroxyquinolin3yl)ethyl)3hydroxy145trimethyl1Himidazol3ium
3(1hydroxy345trimethylimidazol3ium2yl)3(2oxo1~(H)quinolin3yl)propanoicacid
InChI=1SC18H19N3O4c11011(2)21(25)18(20(10)3)14(916(22)23)13812645715(12)1917(13)24h4814H9H213H3(H21922232425)p+1
ZINC000604404994
ZINC000604404995
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