Vitas-M small molecule compound
5-acetyl-3-hexyl-2-hydroxy-6-oxo-3,6-dihydropyrimidin-4-olate
Catalog ID
STL048804
SMILES CCCCCCn1c(O)nc(=O)c(c1[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 C12H17N2O4 MW 253.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N2O4/c1-3-4-5-6-7-14-11(17)9(8(2)15)10(16)13-12(14)18/h17H,3-7H2,1-2H3,(H,13,16,18)/p-1InChIKey
JPWYVJKWABDKNI-UHFFFAOYSA-MSynonyms
5acetyl3hexyl26dioxopyrimidin4olate
5acetyl3hexyl2hydroxy6oxo36dihydropyrimidin4olate
CCCCCCN1C(=C(C(=O)NC1=O)C(=O)C)(O)
CCCCCCn1c(O)nc(=O)c(c1(O))C(=O)C
InChI=1SC12H18N2O4c1345671411(17)9(8(2)15)10(16)1312(14)18h17H37H212H3(H131618)p1
ZINC000001898443
ZINC01898443
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