Vitas-M small molecule compound
2-[(Z)-2-(2,3-dimethoxyphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Catalog ID
STL358701
SMILES COc1c(cccc1OC)/C=C\c1nc(O)c(c(=O)[nH]1)[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 C14H13N3O6 MW 319.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N3O6/c1-22-9-5-3-4-8(12(9)23-2)6-7-10-15-13(18)11(17(20)21)14(19)16-10/h3-7H,1-2H3,(H2,15,16,18,19)/b7-6-InChIKey
CVLULYRPLFJFRB-SREVYHEPSA-NSynonyms
2((1Z)2(23DIMETHOXYPHENYL)VINYL)6HYDROXY5NITRO3HYDROPYRIMIDIN4ONE
2((Z)2(23DIMETHOXYPHENYL)ETHENYL)4HYDROXY5NITRO1HPYRIMIDIN6ONE
2((Z)2(23dimethoxyphenyl)ethenyl)6hydroxy5nitropyrimidin4(3H)one
2((Z)2(23DIMETHOXYPHENYL)VINYL)6HYDROXY5NITRO3HPYRIMIDIN4ONE
COC1=CC=CC(=C1OC)C=CC2=NC(=C(C(=O)N2)(N+)(=O)(O))O
COc1c(cccc1OC)C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O)
InChI=1SC14H13N3O6c12295348(12(9)232)67101513(18)11(17(20)21)14(19)1610h37H12H3(H215161819)b76
MFCD06010609
ZINC000009010353
ZINC09010353
ZINC9010353
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