(2R,3R,4R,5R)-2-[6-[2-[(6-azanyl-7H-purin-8-yl)amino]ethylamino]purin-9-yl]-5-(hydroxymethyl)-3-methyl-oxolane-3,4-diol

Systemtic Name: (2R,3R,4R,5R)-2-[6-[2-[(6-azanyl-7H-purin-8-yl)amino]ethylamino]purin-9-yl]-5-(hydroxymethyl)-3-methyl-oxolane-3,4-diol Openeye Name: (2R,3R,4R,5R)-2-[6-[2-[(6-amino-7H-purin-8-yl)amino]ethylamino]purin-9-yl]-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-3,4-diol CAS Name: (2R,3R,4R,5R)-2-[6-[2-[(6-amino-7H-purin-8-yl)amino]ethylamino]-9-purinyl]-5-(hydroxymethyl)-3-methyloxolane-3,4-diol IUPAC Name: (2R,3R,4R,5R)-2-[6-[2-[(6-amino-7H-purin-8-yl)amino]ethylamino]purin-9-yl]-5-(hydroxymethyl)-3-methyloxolane-3,4-diol Traditional Name: (2R,3R,4R,5R)-2-[6-[2-[(6-amino-7H-purin-8-yl)amino]ethylamino]purin-9-yl]-3-methyl-5-methylol-tetrahydrofuran-3,4-diol Formula: C18H23N11O4 MolecularWeight: 457.44652

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(OC1N2C=NC3=C2N=CN=C3NCCNC4=NC5=C(N4)C(=NC=N5)N)CO)O)O

Isomeric SMILES

C[C@]1([C@@H]([C@H](O[C@H]1N2C=NC3=C2N=CN=C3NCCNC4=NC5=C(N4)C(=NC=N5)N)CO)O)O

InChI

InChI=1S/C18H23N11O4/c1-18(32)11(31)8(4-30)33-16(18)29-7-26-10-13(23-6-25-15(10)29)20-2-3-21-17-27-9-12(19)22-5-24-14(9)28-17/h5-8,11,16,30-32H,2-4H2,1H3,(H,20,23,25)(H4,19,21,22,24,27,28)/t8-,11-,16-,18-/m1/s1