Vitas-M small molecule compound

methyl 4,6-dihydroxy-5-[3-methoxy-3-oxo-1-(quinoxalin-6-yl)propyl]pyridine-3-carboxylate

Catalog ID
STL424215
SMILES COC(=O)CC(c1c(O)ncc(c1O)C(=O)OC)c1ccc2c(c1)nccn2

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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 C19H17N3O6 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O6/c1-27-15(23)8-11(10-3-4-13-14(7-10)21-6-5-20-13)16-17(24)12(19(26)28-2)9-22-18(16)25/h3-7,9,11H,8H2,1-2H3,(H2,22,24,25)
InChIKey
LJPMWCTXRPOVAB-UHFFFAOYSA-N
Synonyms
1676083-00-3
1676083003
COC(=O)CC(C1=CC2=NC=CN=C2C=C1)C3=C(C(=CNC3=O)C(=O)OC)O
InChI=1SC19H17N3O6c12715(23)811(10341314(710)21652013)1617(24)12(19(26)282)92218(16)25h37911H8H212H3(H2222425)
methyl46dihydroxy5(3methoxy3oxo1(quinoxalin6yl)propyl)pyridine3carboxylate
methyl4hydroxy5(3methoxy3oxo1quinoxalin6ylpropyl)6oxo1Hpyridine3carboxylate
MFCD30709242
ZINC000218611826
ZINC000218611904

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Available files

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