Vitas-M small molecule compound
6-hydroxy-8-[(2-hydroxyethyl)amino]-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK575557
SMILES OCCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C
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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 C18H23N5O5 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O5/c1-11-3-5-13(6-4-11)28-10-12(25)9-23-14-15(20-17(23)19-7-8-24)22(2)18(27)21-16(14)26/h3-6,12,24-25H,7-10H2,1-2H3,(H,19,20)(H,21,26,27)InChIKey
VIOMEDYMZQYAHC-UHFFFAOYSA-NSynonyms
877797-66-56hydroxy8((2hydroxyethyl)amino)7(2hydroxy3(4methylphenoxy)propyl)3methyl37dihydro2Hpurin2one
8(2HYDROXYETHYLAMINO)7(2HYDROXY3(4METHYLPHENOXY)PROPYL)3METHYLPURINE26DIONE
CC1=CC=C(C=C1)OCC(CN2C3=C(N=C2NCCO)N(C(=O)NC3=O)C)O
InChI=1SC18H23N5O5c1113513(6411)281012(25)9231415(2017(23)197824)22(2)18(27)2116(14)26h36122425H710H212H3(H1920)(H212627)
MFCD07203718
ZINC000005461026
ZINC000005461037
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