(2R,4R,5R)-2-(6-azanyl-2-pent-1-ynyl-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: (2R,4R,5R)-2-(6-azanyl-2-pent-1-ynyl-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: (2R,4R,5R)-2-(6-amino-2-pent-1-ynyl-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: (2R,4R,5R)-2-(6-amino-2-pent-1-ynyl-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: (2R,4R,5R)-2-(6-amino-2-pent-1-ynylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: (2R,4R,5R)-2-(6-amino-2-pent-1-ynyl-purin-9-yl)-5-methylol-tetrahydrofuran-3,4-diol Formula: C15H19N5O4 MolecularWeight: 333.34246

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H19N5O4/c1-2-3-4-5-9-18-13(16)10-14(19-9)20(7-17-10)15-12(23)11(22)8(6-21)24-15/h7-8,11-12,15,21-23H,2-3,6H2,1H3,(H2,16,18,19)/t8-,11+,12?,15-/m1/s1