Vitas-M small molecule compound

3-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-4H-chromen-4-one

Catalog ID
STK621591
SMILES Oc1nc(/C=C/c2coc3c(c2=O)cccc3)c(c(n1)O)[N+](=O)[O-]

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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 C15H9N3O6 MW 327.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9N3O6/c19-13-8(7-24-11-4-2-1-3-9(11)13)5-6-10-12(18(22)23)14(20)17-15(21)16-10/h1-7H,(H2,16,17,20,21)/b6-5+
InChIKey
PKTWEXSAXMPPNB-AATRIKPKSA-N
Synonyms
801228-13-7
801228137
MFCD09791834
Oc1nc(C=Cc2coc3c(c2=O)cccc3)c(c(n1)O)(N+)(=O)(O)
ZINC000004510890

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Available files

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