Vitas-M small molecule compound
5-(2-hydroxy-3-methyl-4-oxo-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-5-yl)-3-methyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Catalog ID
STL057956
SMILES O=c1[nH]c(=O)n(c(c1C1c2ccccc2Oc2c1c(=O)n(c(n2)O)C)[O-])C
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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 C17H13N4O6 MW 369.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O6/c1-20-14(23)10(12(22)18-16(20)25)9-7-5-3-4-6-8(7)27-13-11(9)15(24)21(2)17(26)19-13/h3-6,9,23H,1-2H3,(H,19,26)(H,18,22,25)/p-1InChIKey
MASJDWPXBFILIB-UHFFFAOYSA-MSynonyms
3METHYL5(3METHYL24DIOXO15DIHYDROCHROMENO(23D)PYRIMIDIN5YL)26DIOXOPYRIMIDIN4OLATE
5(2hydroxy3methyl4oxo35dihydro4Hchromeno(23d)pyrimidin5yl)3methyl26dioxo1236tetrahydropyrimidin4olate
CN1C(=C(C(=O)NC1=O)C2C3=CC=CC=C3OC4=C2C(=O)N(C(=O)N4)C)(O)
InChI=1SC17H14N4O6c12014(23)10(12(22)1816(20)25)9753468(7)271311(9)15(24)21(2)17(26)1913h36923H12H3(H1926)(H182225)p1
O=c1(nH)c(=O)n(c(c1C1c2ccccc2Oc2c1c(=O)n(c(n2)O)C)(O))C
ZINC000009348399
ZINC000009348401
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