Vitas-M small molecule compound

2-[(E)-2-(4-butoxyphenyl)ethenyl]-5-nitropyrimidine-4,6-diol

Catalog ID
STL416120
SMILES CCCCOc1ccc(cc1)/C=C/c1nc(O)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 C16H17N3O5 MW 331.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O5/c1-2-3-10-24-12-7-4-11(5-8-12)6-9-13-17-15(20)14(19(22)23)16(21)18-13/h4-9H,2-3,10H2,1H3,(H2,17,18,20,21)/b9-6+
InChIKey
GVMIPZONMIVMIB-RMKNXTFCSA-N
Synonyms

2((E)2(4butoxyphenyl)ethenyl)5nitropyrimidine46diol
CCCCOc1ccc(cc1)C=Cc1nc(O)c(c(n1)O)(N+)(=O)(O)
MFCD30706979
ZINC000009295534

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Available files

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