2-azanyl-9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-1-octanoyl-purin-6-one

Systemtic Name: 2-azanyl-9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-1-octanoyl-purin-6-one Openeye Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-octanoyl-purin-6-one CAS Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-1-(1-oxooctyl)-6-purinone IUPAC Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-octanoylpurin-6-one Traditional Name: 2-amino-1-caprylyl-9-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)purin-6-one Formula: C18H27N5O5 MolecularWeight: 393.43748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1C(=O)C2=C(N=C1N)N(C=N2)C3CC(C(O3)CO)O

Isomeric SMILES

CCCCCCCC(=O)N1C(=O)C2=C(N=C1N)N(C=N2)C3CC(C(O3)CO)O

InChI

InChI=1S/C18H27N5O5/c1-2-3-4-5-6-7-13(26)23-17(27)15-16(21-18(23)19)22(10-20-15)14-8-11(25)12(9-24)28-14/h10-12,14,24-25H,2-9H2,1H3,(H2,19,21)