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

Systemtic Name: (2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oct-2-ynyl-oxolan-3-ol Openeye Name: (2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oct-2-ynyl-tetrahydrofuran-3-ol CAS Name: (2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oct-2-ynyl-3-oxolanol IUPAC Name: (2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oct-2-ynyloxolan-3-ol Traditional Name: (2R,3S,4R,5R)-5-adenin-9-yl-2-methylol-4-oct-2-ynyl-tetrahydrofuran-3-ol Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CCC1C(C(OC1N2C=NC3=C2N=CN=C3N)CO)O

Isomeric SMILES

CCCCCC#CC[C@@H]1[C@@H]([C@H](O[C@H]1N2C=NC3=C2N=CN=C3N)CO)O

InChI

InChI=1S/C18H25N5O3/c1-2-3-4-5-6-7-8-12-15(25)13(9-24)26-18(12)23-11-22-14-16(19)20-10-21-17(14)23/h10-13,15,18,24-25H,2-5,8-9H2,1H3,(H2,19,20,21)/t12-,13-,15+,18-/m1/s1