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1,3-dibutyl-7-[3,4,5-tris(oxidanyl)oxan-2-yl]oxy-purine-2,6-dione

1,3-dibutyl-7-[3,4,5-tris(oxidanyl)oxan-2-yl]oxy-purine-2,6-dione

Systemtic Name:1,3-dibutyl-7-[3,4,5-tris(oxidanyl)oxan-2-yl]oxy-purine-2,6-dione
Openeye Name:1,3-dibutyl-7-(3,4,5-trihydroxytetrahydropyran-2-yl)oxy-purine-2,6-dione
CAS Name:1,3-dibutyl-7-[(3,4,5-trihydroxy-2-oxanyl)oxy]purine-2,6-dione
IUPAC Name:1,3-dibutyl-7-(3,4,5-trihydroxyoxan-2-yl)oxypurine-2,6-dione
Traditional Name:1,3-dibutyl-7-(3,4,5-trihydroxytetrahydropyran-2-yl)oxy-xanthine
Formula: C18H28N4O7
MolecularWeight: 412.43752
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N(C=N2)OC3C(C(C(CO3)O)O)O


Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N(C=N2)OC3C(C(C(CO3)O)O)O


InChI

InChI=1S/C18H28N4O7/c1-3-5-7-20-15-12(16(26)21(18(20)27)8-6-4-2)22(10-19-15)29-17-14(25)13(24)11(23)9-28-17/h10-11,13-14,17,23-25H,3-9H2,1-2H3


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