Vitas-M small molecule compound
3-hydroxy-6-(hydroxymethyl)-2-{[4-(pyrimidin-2-yl)-1,4-diazepan-1-yl]methyl}-4H-pyran-4-one
Catalog ID
STL158150
SMILES OCc1oc(CN2CCCN(CC2)c2ncccn2)c(c(=O)c1)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 C16H20N4O4 MW 332.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O4/c21-11-12-9-13(22)15(23)14(24-12)10-19-5-2-6-20(8-7-19)16-17-3-1-4-18-16/h1,3-4,9,21,23H,2,5-8,10-11H2InChIKey
RVXXVUWNGCABKU-UHFFFAOYSA-NSynonyms
1282141-91-61282141916
3hydroxy6(hydroxymethyl)2((4(pyrimidin2yl)14diazepan1yl)methyl)4Hpyran4one
3hydroxy6(hydroxymethyl)2((4pyrimidin2yl14diazepan1yl)methyl)pyran4one
C1CN(CCN(C1)C2=NC=CC=N2)CC3=C(C(=O)C=C(O3)CO)O
InChI=1SC16H20N4O4c211112913(22)15(23)14(2412)101952620(8719)16173141816h13492123H2581011H2
MFCD18800356
ZINC000061722154
ZINC61722154
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