1-[10,11-bis(oxidanyl)undecyl]-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 1-[10,11-bis(oxidanyl)undecyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-(10,11-dihydroxyundecyl)-3,7-dimethyl-purine-2,6-dione CAS Name: 1-(10,11-dihydroxyundecyl)-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-(10,11-dihydroxyundecyl)-3,7-dimethylpurine-2,6-dione Traditional Name: 1-(10,11-dihydroxyundecyl)-3,7-dimethyl-xanthine Formula: C18H30N4O4 MolecularWeight: 366.4552

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCC(CO)O

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCCCCC(CO)O

InChI

InChI=1S/C18H30N4O4/c1-20-13-19-16-15(20)17(25)22(18(26)21(16)2)11-9-7-5-3-4-6-8-10-14(24)12-23/h13-14,23-24H,3-12H2,1-2H3