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7-[10-(6-aminopurin-9-yl)decyl]-1,3-dimethyl-purine-2,6-dione

7-[10-(6-aminopurin-9-yl)decyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name:7-[10-(6-aminopurin-9-yl)decyl]-1,3-dimethyl-purine-2,6-dione
Openeye Name:7-[10-(6-aminopurin-9-yl)decyl]-1,3-dimethyl-purine-2,6-dione
CAS Name:7-[10-(6-aminopurin-9-yl)decyl]-1,3-dimethylpurine-2,6-dione
IUPAC Name:7-[10-(6-aminopurin-9-yl)decyl]-1,3-dimethylpurine-2,6-dione
Traditional Name:7-(10-adenin-9-yldecyl)-1,3-dimethyl-xanthine
Formula: C22H31N9O2
MolecularWeight: 453.54064
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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCCCCCCCN3C=NC4=C3N=CN=C4N


Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCCCCCCCN3C=NC4=C3N=CN=C4N


InChI

InChI=1S/C22H31N9O2/c1-28-20-17(21(32)29(2)22(28)33)30(15-27-20)11-9-7-5-3-4-6-8-10-12-31-14-26-16-18(23)24-13-25-19(16)31/h13-15H,3-12H2,1-2H3,(H2,23,24,25)


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