Vitas-M small molecule compound
1,3-dimethyl-2,6-dioxo-8-(pyridinium-1-yl)-1,2,3,6-tetrahydropurin-7-ide
Catalog ID
STK534375
SMILES Cn1c2nc([n-]c2c(=O)n(c1=O)C)[n+]1ccccc1
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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 C12H11N5O2 MW 257.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5O2/c1-15-9-8(10(18)16(2)12(15)19)13-11(14-9)17-6-4-3-5-7-17/h3-7H,1-2H3InChIKey
APSKWJBCTCBPQA-UHFFFAOYSA-NSynonyms
52943-89-213dimethyl26dioxo8(pyridin1ium1yl)1236tetrahydropurin7ide
13dimethyl26dioxo8(pyridinium1yl)1236tetrahydropurin7ide
13DIMETHYL2OXO8PYRIDIN1IUM1YLPURIN6OLATE
13DIMETHYL8PYRIDYL137TRIHYDROPURINE26DIONE
52943892
CN1C(=C2C(=NC(=N2)(N+)3=CC=CC=C3)N(C1=O)C)(O)
Cn1c2nc((n)c2c(=O)n(c1=O)C)(n+)1ccccc1
InChI=1SC12H11N5O2c11598(10(18)16(2)12(15)19)1311(149)176435717h37H12H3
MFCD00267737
ZINC000004790047
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