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

Systemtic Name: (2R,3R,5S)-2-(6-azanyl-2-oct-1-ynyl-purin-9-yl)-5-(hydroxymethyl)oxolan-3-ol Openeye Name: (2R,3R,5S)-2-(6-amino-2-oct-1-ynyl-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: (2R,3R,5S)-2-(6-amino-2-oct-1-ynyl-9-purinyl)-5-(hydroxymethyl)-3-oxolanol IUPAC Name: (2R,3R,5S)-2-(6-amino-2-oct-1-ynylpurin-9-yl)-5-(hydroxymethyl)oxolan-3-ol Traditional Name: (2R,3R,5S)-2-(6-amino-2-oct-1-ynyl-purin-9-yl)-5-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=CN2C3C(CC(O3)CO)O

Isomeric SMILES

CCCCCCC#CC1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H](C[C@H](O3)CO)O

InChI

InChI=1S/C18H25N5O3/c1-2-3-4-5-6-7-8-14-21-16(19)15-17(22-14)23(11-20-15)18-13(25)9-12(10-24)26-18/h11-13,18,24-25H,2-6,9-10H2,1H3,(H2,19,21,22)/t12-,13+,18+/m0/s1