2-(6-aminopurin-9-yl)-5-[[(7-methoxy-3,4-dihydro-2H-chromen-3-yl)amino]oxymethyl]oxolane-3,4-diol

Systemtic Name: 2-(6-aminopurin-9-yl)-5-[[(7-methoxy-3,4-dihydro-2H-chromen-3-yl)amino]oxymethyl]oxolane-3,4-diol Openeye Name: 2-(6-aminopurin-9-yl)-5-[[(7-methoxychroman-3-yl)amino]oxymethyl]tetrahydrofuran-3,4-diol CAS Name: 2-(6-aminopurin-9-yl)-5-[[(7-methoxy-3,4-dihydro-2H-1-benzopyran-3-yl)amino]oxymethyl]oxolane-3,4-diol IUPAC Name: 2-(6-aminopurin-9-yl)-5-[[(7-methoxy-3,4-dihydro-2H-chromen-3-yl)amino]oxymethyl]oxolane-3,4-diol Traditional Name: 2-adenin-9-yl-5-[[(7-methoxychroman-3-yl)amino]oxymethyl]tetrahydrofuran-3,4-diol Formula: C20H24N6O6 MolecularWeight: 444.44116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC(CO2)NOCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O)C=C1

Isomeric SMILES

COC1=CC2=C(CC(CO2)NOCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O)C=C1

InChI

InChI=1S/C20H24N6O6/c1-29-12-3-2-10-4-11(6-30-13(10)5-12)25-31-7-14-16(27)17(28)20(32-14)26-9-24-15-18(21)22-8-23-19(15)26/h2-3,5,8-9,11,14,16-17,20,25,27-28H,4,6-7H2,1H3,(H2,21,22,23)