2-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1-(3-methylpentanoyl)purin-6-one

Systemtic Name: 2-azanyl-9-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1-(3-methylpentanoyl)purin-6-one Openeye Name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-(3-methylpentanoyl)purin-6-one CAS Name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-1-(3-methyl-1-oxopentyl)-6-purinone IUPAC Name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-(3-methylpentanoyl)purin-6-one Traditional Name: 2-amino-9-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-1-(3-methylpentanoyl)purin-6-one Formula: C16H23N5O6 MolecularWeight: 381.38372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)N1C(=O)C2=C(N=C1N)N(C=N2)C3C(C(C(O3)CO)O)O

Isomeric SMILES

CCC(C)CC(=O)N1C(=O)C2=C(N=C1N)N(C=N2)C3C(C(C(O3)CO)O)O

InChI

InChI=1S/C16H23N5O6/c1-3-7(2)4-9(23)21-14(26)10-13(19-16(21)17)20(6-18-10)15-12(25)11(24)8(5-22)27-15/h6-8,11-12,15,22,24-25H,3-5H2,1-2H3,(H2,17,19)