Vitas-M small molecule compound
6-[(E)-2-(4-hydroxy-3-iodo-5-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
Catalog ID
STK111009
SMILES COc1cc(/C=C/c2nc(O)nc(c2[N+](=O)[O-])O)cc(c1O)I
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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 C13H10IN3O6 MW 431.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10IN3O6/c1-23-9-5-6(4-7(14)11(9)18)2-3-8-10(17(21)22)12(19)16-13(20)15-8/h2-5,18H,1H3,(H2,15,16,19,20)/b3-2+InChIKey
CJICHCSNGGGKMI-NSCUHMNNSA-NSynonyms
6((E)2(4HYDROXY3IODO5METHOXYPHENYL)ETHENYL)5NITRO1HPYRIMIDINE24DIONE
6((E)2(4HYDROXY3IODO5METHOXYPHENYL)ETHENYL)5NITROPYRIMIDINE24DIOL
COC1=C(C(=CC(=C1)C=CC2=C(C(=O)NC(=O)N2)(N+)(=O)(O))I)O
COc1cc(C=Cc2nc(O)nc(c2(N+)(=O)(O))O)cc(c1O)I
InChI=1SC13H10IN3O6c123956(47(14)11(9)18)23810(17(21)22)12(19)1613(20)158h2518H1H3(H215161920)b32+
MFCD03928096
ZINC000009763253
ZINC9763253
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