Molecule ID: 135455418

IUPAC Name: 2-amino-9-[(1R)-1-(1,3-dihydroxypropan-2-yloxy)-2-hydroxyethyl]-1H-purin-6-one

Description: The molecule is a triol obtained by sequential periodate-oxidation and borohydride-reduction of guanosine. It is a member of 2-aminopurines, an oxopurine and a triol.

SMILES: N=c1nc(O)c2ncn([C@@H](CO)OC(CO)CO)c2[nH]1

SELFIES: [N][=C][N][=C][Branch1][C][O][C][N][=C][N][Branch1][=C][C@@H1][Branch1][Ring1][C][O][O][C][Branch1][Ring1][C][O][C][O][C][=Ring1][=C][NH1][Ring2][Ring1][Ring1]

InChI: InChI=1S/C10H15N5O5/c11-10-13-8-7(9(19)14-10)12-4-15(8)6(3-18)20-5(1-16)2-17/h4-6,16-18H,1-3H2,(H3,11,13,14,19)/t6-/m1/s1

Molecular Properties:
- Polar Surface Area: 155.0 Ų
- LogP: -3.2