2-azanyl-9-[3,5-bis(hydroxymethyl)-2,4-dimethyl-cyclohexyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[3,5-bis(hydroxymethyl)-2,4-dimethyl-cyclohexyl]-3H-purin-6-one Openeye Name: 2-amino-9-[3,5-bis(hydroxymethyl)-2,4-dimethyl-cyclohexyl]-3H-purin-6-one CAS Name: 2-amino-9-[3,5-bis(hydroxymethyl)-2,4-dimethylcyclohexyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[3,5-bis(hydroxymethyl)-2,4-dimethylcyclohexyl]-3H-purin-6-one Traditional Name: 2-amino-9-(2,4-dimethyl-3,5-dimethylol-cyclohexyl)-3H-purin-6-one Formula: C15H23N5O3 MolecularWeight: 321.37482

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(C(C1CO)C)N2C=NC3=C2NC(=NC3=O)N)CO

Isomeric SMILES

CC1C(CC(C(C1CO)C)N2C=NC3=C2NC(=NC3=O)N)CO

InChI

InChI=1S/C15H23N5O3/c1-7-9(4-21)3-11(8(2)10(7)5-22)20-6-17-12-13(20)18-15(16)19-14(12)23/h6-11,21-22H,3-5H2,1-2H3,(H3,16,18,19,23)