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7-hexadecyl-8-(2-hydroxyethylamino)-3-methyl-purine-2,6-dione

7-hexadecyl-8-(2-hydroxyethylamino)-3-methyl-purine-2,6-dione

Systemtic Name:7-hexadecyl-8-(2-hydroxyethylamino)-3-methyl-purine-2,6-dione
Openeye Name:7-hexadecyl-8-(2-hydroxyethylamino)-3-methyl-purine-2,6-dione
CAS Name:7-hexadecyl-8-(2-hydroxyethylamino)-3-methylpurine-2,6-dione
IUPAC Name:7-hexadecyl-8-(2-hydroxyethylamino)-3-methylpurine-2,6-dione
Traditional Name:7-cetyl-8-(2-hydroxyethylamino)-3-methyl-xanthine
Formula: C24H43N5O3
MolecularWeight: 449.62992
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=C(N=C1NCCO)N(C(=O)NC2=O)C


Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=C(N=C1NCCO)N(C(=O)NC2=O)C


InChI

InChI=1S/C24H43N5O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-29-20-21(26-23(29)25-17-19-30)28(2)24(32)27-22(20)31/h30H,3-19H2,1-2H3,(H,25,26)(H,27,31,32)


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