5-(6-azanyl-2-oct-1-ynyl-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: 5-(6-azanyl-2-oct-1-ynyl-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 5-(6-amino-2-oct-1-ynyl-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 5-(6-amino-2-oct-1-ynyl-9-purinyl)-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 5-(6-amino-2-oct-1-ynylpurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-(6-amino-2-oct-1-ynyl-purin-9-yl)-2-methylol-tetrahydrofuran-3-ol Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=NC2=C(C(=N1)N)N=CN2C3CC(C(O3)CO)O

Isomeric SMILES

CCCCCCC#CC1=NC2=C(C(=N1)N)N=CN2C3CC(C(O3)CO)O

InChI

InChI=1S/C18H25N5O3/c1-2-3-4-5-6-7-8-14-21-17(19)16-18(22-14)23(11-20-16)15-9-12(25)13(10-24)26-15/h11-13,15,24-25H,2-6,9-10H2,1H3,(H2,19,21,22)