Vitas-M small molecule compound
3-benzyl-2,6-dihydroxy-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)pyrimidin-4(3H)-one
Catalog ID
STL534776
SMILES Oc1nc(O)n(c(=O)c1C1NCCc2c1[nH]c1c2cccc1)Cc1ccccc1
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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 C22H20N4O3 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3/c27-20-17(21(28)26(22(29)25-20)12-13-6-2-1-3-7-13)19-18-15(10-11-23-19)14-8-4-5-9-16(14)24-18/h1-9,19,23-24,27H,10-12H2,(H,25,29)InChIKey
XWSOWJPAZNPGOJ-UHFFFAOYSA-NSynonyms
3benzyl26dihydroxy5(2349tetrahydro1Hbetacarbolin1yl)pyrimidin4(3H)one
InChI=1SC22H20N4O3c272017(21(28)26(22(29)2520)12136213713)191815(10112319)14845916(14)2418h1919232427H1012H2(H2529)
MFCD08729768
ZINC000018208633
ZINC000020412436
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