Vitas-M small molecule compound
6-[(E)-2-(5-chloro-2-hydroxy-3-methoxyphenyl)ethenyl]-5-nitropyrimidine-2,4-diol
Catalog ID
STL381160
SMILES COc1cc(Cl)cc(c1O)/C=C/c1nc(O)nc(c1[N+](=O)[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 C13H10ClN3O6 MW 339.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10ClN3O6/c1-23-9-5-7(14)4-6(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
ZZWAUBWBBJURII-NSCUHMNNSA-NSynonyms
6((E)2(5CHLORO2HYDROXY3METHOXYPHENYL)ETHENYL)5NITRO1HPYRIMIDINE24DIONE
6((E)2(5chloro2hydroxy3methoxyphenyl)ethenyl)5nitropyrimidine24diol
COC1=C(C(=CC(=C1)Cl)C=CC2=C(C(=O)NC(=O)N2)(N+)(=O)(O))O
COc1cc(Cl)cc(c1O)C=Cc1nc(O)nc(c1(N+)(=O)(O))O
InChI=1SC13H10ClN3O6c123957(14)46(11(9)18)23810(17(21)22)12(19)1613(20)158h2518H1H3(H215161920)b32+
MFCD04083052
ZINC000006641313
ZINC6641313
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