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

Systemtic Name: [(2S,4S,5R)-4-acetyloxy-5-(6-aminopurin-9-yl)-2-(ethylcarbamoyl)oxolan-3-yl] ethanoate Openeye Name: [(2S,4S,5R)-4-acetoxy-5-(6-aminopurin-9-yl)-2-(ethylcarbamoyl)tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [(2S,4S,5R)-4-acetyloxy-5-(6-aminopurin-9-yl)-2-(ethylcarbamoyl)-3-oxolanyl] ester IUPAC Name: [(2S,4S,5R)-4-acetyloxy-5-(6-aminopurin-9-yl)-2-(ethylcarbamoyl)oxolan-3-yl] acetate Traditional Name: acetic acid [(2S,4S,5R)-4-acetoxy-5-adenin-9-yl-2-(ethylcarbamoyl)tetrahydrofuran-3-yl] ester Formula: C16H20N6O6 MolecularWeight: 392.3666

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3N)OC(=O)C)OC(=O)C

Isomeric SMILES

CCNC(=O)[C@@H]1C([C@@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)OC(=O)C)OC(=O)C

InChI

InChI=1S/C16H20N6O6/c1-4-18-15(25)11-10(26-7(2)23)12(27-8(3)24)16(28-11)22-6-21-9-13(17)19-5-20-14(9)22/h5-6,10-12,16H,4H2,1-3H3,(H,18,25)(H2,17,19,20)/t10?,11-,12-,16+/m0/s1