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

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

Systemtic Name:8-(dibutylamino)-7-hexadecyl-3-methyl-purine-2,6-dione
Openeye Name:8-(dibutylamino)-7-hexadecyl-3-methyl-purine-2,6-dione
CAS Name:8-(dibutylamino)-7-hexadecyl-3-methylpurine-2,6-dione
IUPAC Name:8-(dibutylamino)-7-hexadecyl-3-methylpurine-2,6-dione
Traditional Name:7-cetyl-8-(dibutylamino)-3-methyl-xanthine
Formula: C30H55N5O2
MolecularWeight: 517.79
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=C(N=C1N(CCCC)CCCC)N(C(=O)NC2=O)C


Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=C(N=C1N(CCCC)CCCC)N(C(=O)NC2=O)C


InChI

InChI=1S/C30H55N5O2/c1-5-8-11-12-13-14-15-16-17-18-19-20-21-22-25-35-26-27(33(4)30(37)32-28(26)36)31-29(35)34(23-9-6-2)24-10-7-3/h5-25H2,1-4H3,(H,32,36,37)


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