Vitas-M small molecule compound
{2-[(E)-{2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-9-ium-7-yl)acetyl]hydrazinylidene}methyl]phenoxy}acetate
Catalog ID
STL044579
SMILES [O-]C(=O)COc1ccccc1/C=N/NC(=O)Cn1c[nH+]c2c1c(=O)n(C)c(=O)n2C
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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 C18H18N6O6 MW 414.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O6/c1-22-16-15(17(28)23(2)18(22)29)24(10-19-16)8-13(25)21-20-7-11-5-3-4-6-12(11)30-9-14(26)27/h3-7,10H,8-9H2,1-2H3,(H,21,25)(H,26,27)/b20-7+InChIKey
YAVRWLBUWUJTOB-IFRROFPPSA-NSynonyms
488804-00-8(2((E)(2((13dimethyl26dioxo1236tetrahydro7Hpurin9ium7yl)acetyl)hydrazinylidene)methyl)phenoxy)acetate
(O)C(=O)COc1ccccc1C=NNC(=O)Cn1c(nH+)c2c1c(=O)n(C)c(=O)n2C
488804008
MFCD02668317
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