Vitas-M small molecule compound
6-hydroxy-7-(2-{2-[2-hydroxy-3-methyl-6-oxo-8-(piperidin-1-yl)-3,6-dihydro-7H-purin-7-yl]ethoxy}ethyl)-3-methyl-8-(piperidin-1-yl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STK559081
SMILES Cn1c(=O)nc(c2c1nc(n2CCOCCn1c(nc2c1c(=O)nc(n2C)O)N1CCCCC1)N1CCCCC1)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 C26H36N10O5 MW 568.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36N10O5/c1-31-19-17(21(37)29-25(31)39)35(23(27-19)33-9-5-3-6-10-33)13-15-41-16-14-36-18-20(32(2)26(40)30-22(18)38)28-24(36)34-11-7-4-8-12-34/h3-16H2,1-2H3,(H,29,37,39)(H,30,38,40)InChIKey
FSRGAHNODFYZFD-UHFFFAOYSA-NSynonyms
3METHYL7(2(2(3METHYL26DIOXO8PIPERIDIN1YLPURIN7YL)ETHOXY)ETHYL)8PIPERIDIN1YLPURINE26DIONE
6hydroxy7(2(2(2hydroxy3methyl6oxo8(piperidin1yl)36dihydro7Hpurin7yl)ethoxy)ethyl)3methyl8(piperidin1yl)37dihydro2Hpurin2one
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCC3)CCOCCN4C5=C(N=C4N6CCCCC6)N(C(=O)NC5=O)C
InChI=1SC26H36N10O5c1311917(21(37)2925(31)39)35(23(2719)3395361033)1315411614361820(32(2)26(40)3022(18)38)2824(36)34117481234h316H212H3(H293739)(H303840)
MFCD04074056
ZINC000005297010
ZINC5297010
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