Vitas-M small molecule compound
6-hydroxy-2-[(E)-2-(2-methoxyphenyl)ethenyl]-5-nitropyrimidin-4(3H)-one
Catalog ID
STK728510
SMILES COc1ccccc1/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 C13H11N3O5 MW 289.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O5/c1-21-9-5-3-2-4-8(9)6-7-10-14-12(17)11(16(19)20)13(18)15-10/h2-7H,1H3,(H2,14,15,17,18)/b7-6+InChIKey
SMZTUGZITRKUQQ-VOTSOKGWSA-NSynonyms
4HYDROXY2((E)2(2METHOXYPHENYL)ETHENYL)5NITRO1HPYRIMIDIN6ONE
5NITRO2(2(2METHOXYPHENYL)VINYL)46PYRIMIDINEDIOL
6hydroxy2((E)2(2methoxyphenyl)ethenyl)5nitropyrimidin4(3H)one
6HYDROXY2(2(2METHOXYPHENYL)VINYL)5NITRO3HPYRIMIDIN4ONE
COC1=CC=CC=C1C=CC2=NC(=C(C(=O)N2)(N+)(=O)(O))O
COc1ccccc1C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O)
InChI=1SC13H11N3O5c121953248(9)67101412(17)11(16(19)20)13(18)1510h27H1H3(H214151718)b76+
MFCD00826890
ZINC000017207183
ZINC17207183
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