5-(6-aminopurin-9-yl)-4-ethynyl-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: 5-(6-aminopurin-9-yl)-4-ethynyl-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 5-(6-aminopurin-9-yl)-4-ethynyl-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 5-(6-aminopurin-9-yl)-4-ethynyl-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 5-(6-aminopurin-9-yl)-4-ethynyl-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-adenin-9-yl-4-ethynyl-2-methylol-tetrahydrofuran-3-ol Formula: C12H13N5O3 MolecularWeight: 275.26332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N5O3/c1-2-6-9(19)7(3-18)20-12(6)17-5-16-8-10(13)14-4-15-11(8)17/h1,4-7,9,12,18-19H,3H2,(H2,13,14,15)