[(2S,3S,4S,5R)-4-acetyloxy-5-(6-aminopurin-9-yl)-2-methanoyl-oxolan-3-yl] ethanoate

Systemtic Name: [(2S,3S,4S,5R)-4-acetyloxy-5-(6-aminopurin-9-yl)-2-methanoyl-oxolan-3-yl] ethanoate Openeye Name: [(2S,3S,4S,5R)-4-acetoxy-5-(6-aminopurin-9-yl)-2-formyl-tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [(2S,3S,4S,5R)-4-acetyloxy-5-(6-aminopurin-9-yl)-2-formyl-3-oxolanyl] ester IUPAC Name: [(2S,3S,4S,5R)-4-acetyloxy-5-(6-aminopurin-9-yl)-2-formyloxolan-3-yl] acetate Traditional Name: acetic acid [(2S,3S,4S,5R)-4-acetoxy-5-adenin-9-yl-2-formyl-tetrahydrofuran-3-yl] ester Formula: C14H15N5O6 MolecularWeight: 349.2988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C1OC(=O)C)N2C=NC3=C2N=CN=C3N)C=O

Isomeric SMILES

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

InChI

InChI=1S/C14H15N5O6/c1-6(21)23-10-8(3-20)25-14(11(10)24-7(2)22)19-5-18-9-12(15)16-4-17-13(9)19/h3-5,8,10-11,14H,1-2H3,(H2,15,16,17)/t8-,10-,11+,14-/m1/s1