Vitas-M small molecule compound
methyl 3-{2-hydroxy-1-[2-(1H-imidazol-4-yl)ethyl]-6-methyl-4-oxo-1,4-dihydropyridin-3-yl}-3-(4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-5-yl)propanoate
Catalog ID
STL549329
SMILES COC(=O)CC(c1cc2cccc3c2n(c1=O)CC3)c1c(=O)cc(n(c1O)CCc1c[nH]cn1)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 C26H26N4O5 MW 474.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O5/c1-15-10-21(31)23(26(34)29(15)9-7-18-13-27-14-28-18)19(12-22(32)35-2)20-11-17-5-3-4-16-6-8-30(24(16)17)25(20)33/h3-5,10-11,13-14,19,34H,6-9,12H2,1-2H3,(H,27,28)InChIKey
DWCFDDSOQBPUSF-UHFFFAOYSA-NSynonyms
InChI=1SC26H26N4O5c1151021(31)23(26(34)29(15)97181327142818)19(1222(32)352)201117534166830(24(16)17)25(20)33h35101113141934H6912H212H3(H2728)
methyl3(2hydroxy1(2(1Himidazol4yl)ethyl)6methyl4oxo14dihydropyridin3yl)3(4oxo12dihydro4Hpyrrolo(321ij)quinolin5yl)propanoate
MFCD31756920
ZINC000888090134
ZINC000888090135
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