Vitas-M small molecule compound
3-[7-(2,3-dihydroxypropyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl]propyl 3,4,5-trimethoxybenzoate
Catalog ID
STL526288
SMILES OCC(Cn1cnc2c1c(=O)n(CCCOC(=O)c1cc(OC)c(c(c1)OC)OC)c(=O)n2C)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 C22H28N4O9 MW 492.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O9/c1-24-19-17(25(12-23-19)10-14(28)11-27)20(29)26(22(24)31)6-5-7-35-21(30)13-8-15(32-2)18(34-4)16(9-13)33-3/h8-9,12,14,27-28H,5-7,10-11H2,1-4H3InChIKey
ONTQMSWAESLKGY-UHFFFAOYSA-NSynonyms
354792-45-33(7(23dihydroxypropyl)3methyl26dioxo2367tetrahydro1Hpurin1yl)propyl345trimethoxybenzoate
3(7(23DIHYDROXYPROPYL)3METHYL26DIOXOPURIN1YL)PROPYL345TRIMETHOXYBENZOATE
3541656
354792453
InChI=1SC22H28N4O9c1241917(25(122319)1014(28)1127)20(29)26(22(24)31)6573521(30)13815(322)18(344)16(913)333h8912142728H571011H214H3
MFCD02925736
ZINC000008740305
ZINC000008740306
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