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3-methyl-1-(2-oxidanylpentyl)-7H-purine-2,6-dione

3-methyl-1-(2-oxidanylpentyl)-7H-purine-2,6-dione

Systemtic Name:3-methyl-1-(2-oxidanylpentyl)-7H-purine-2,6-dione
Openeye Name:1-(2-hydroxypentyl)-3-methyl-7H-purine-2,6-dione
CAS Name:1-(2-hydroxypentyl)-3-methyl-7H-purine-2,6-dione
IUPAC Name:1-(2-hydroxypentyl)-3-methyl-7H-purine-2,6-dione
Traditional Name:1-(2-hydroxypentyl)-3-methyl-7H-purine-2,6-quinone
Formula: C11H16N4O3
MolecularWeight: 252.26974
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CN1C(=O)C2=C(N=CN2)N(C1=O)C)O


Isomeric SMILES

CCCC(CN1C(=O)C2=C(N=CN2)N(C1=O)C)O


InChI

InChI=1S/C11H16N4O3/c1-3-4-7(16)5-15-10(17)8-9(13-6-12-8)14(2)11(15)18/h6-7,16H,3-5H2,1-2H3,(H,12,13)


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