Vitas-M small molecule compound
methyl {2-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]-6-methoxyphenoxy}acetate
Catalog ID
STL367335
SMILES COC(=O)COc1c(cccc1OC)/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 C16H15N3O8 MW 377.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O8/c1-25-11-5-3-4-9(14(11)27-8-12(20)26-2)6-7-10-13(19(23)24)15(21)18-16(22)17-10/h3-7H,8H2,1-2H3,(H2,17,18,21,22)/b7-6+InChIKey
VALGBMAMOYDYGE-VOTSOKGWSA-NSynonyms
COC(=O)COc1c(cccc1OC)C=Cc1nc(O)nc(c1(N+)(=O)(O))O
InChI=1SC16H15N3O8c125115349(14(11)27812(20)262)671013(19(23)24)15(21)1816(22)1710h37H8H212H3(H217182122)b76+
methyl(2((E)2(26dihydroxy5nitropyrimidin4yl)ethenyl)6methoxyphenoxy)acetate
METHYL2(2METHOXY6((E)2(5NITRO24DIOXO1HPYRIMIDIN6YL)ETHENYL)PHENOXY)ACETATE
MFCD27966516
ZINC000015009343
ZINC15009343
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