(2R,5S)-5-(6-aminopurin-9-yl)-2,4-diethynyl-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: (2R,5S)-5-(6-aminopurin-9-yl)-2,4-diethynyl-2-(hydroxymethyl)oxolan-3-ol Openeye Name: (2R,5S)-5-(6-aminopurin-9-yl)-2,4-diethynyl-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: (2R,5S)-5-(6-aminopurin-9-yl)-2,4-diethynyl-2-(hydroxymethyl)-3-oxolanol IUPAC Name: (2R,5S)-5-(6-aminopurin-9-yl)-2,4-diethynyl-2-(hydroxymethyl)oxolan-3-ol Traditional Name: (2R,5S)-5-adenin-9-yl-2,4-diethynyl-2-methylol-tetrahydrofuran-3-ol Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1C(C(OC1N2C=NC3=C2N=CN=C3N)(CO)C#C)O

Isomeric SMILES

C#CC1[C@H](O[C@@](C1O)(CO)C#C)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C14H13N5O3/c1-3-8-10(21)14(4-2,5-20)22-13(8)19-7-18-9-11(15)16-6-17-12(9)19/h1-2,6-8,10,13,20-21H,5H2,(H2,15,16,17)/t8?,10?,13-,14+/m0/s1