2-(6-aminopurin-9-yl)-2-(2-cyclohexa-1,3-dien-1-ylpropan-2-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-(6-aminopurin-9-yl)-2-(2-cyclohexa-1,3-dien-1-ylpropan-2-yl)-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-(6-aminopurin-9-yl)-2-(1-cyclohexa-1,3-dien-1-yl-1-methyl-ethyl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(6-aminopurin-9-yl)-2-[2-(1-cyclohexa-1,3-dienyl)propan-2-yl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-(6-aminopurin-9-yl)-2-(2-cyclohexa-1,3-dien-1-ylpropan-2-yl)-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-adenin-9-yl-2-(1-cyclohexa-1,3-dien-1-yl-1-methyl-ethyl)-5-methylol-tetrahydrofuran-3,4-diol Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CCC1)C2(C(C(C(O2)CO)O)O)N3C=NC4=C3N=CN=C4N

Isomeric SMILES

CC(C)(C1=CC=CCC1)C2(C(C(C(O2)CO)O)O)N3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C19H25N5O4/c1-18(2,11-6-4-3-5-7-11)19(15(27)14(26)12(8-25)28-19)24-10-23-13-16(20)21-9-22-17(13)24/h3-4,6,9-10,12,14-15,25-27H,5,7-8H2,1-2H3,(H2,20,21,22)