Molecule ID: 71443293

IUPAC Name: 5-(4,5-dihydroxypentyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione

Description: The molecule is a pyrimidine 2'-deoxyribonucleoside having 5-(4,5-dihydroxypentyl)uracil as the nucleobase. It has a role as a Mycoplasma genitalium metabolite. It derives from a 2'-deoxyuridine.

SMILES: O=c1nc(O)c(CCCC(O)CO)cn1[C@H]1C[C@H](O)[C@@H](CO)O1

SELFIES: [O][=C][N][=C][Branch1][C][O][C][Branch1][#Branch2][C][C][C][C][Branch1][C][O][C][O][=C][N][Ring1][=C][C@H1][C][C@H1][Branch1][C][O][C@@H1][Branch1][Ring1][C][O][O][Ring1][Branch2]

InChI: InChI=1S/C14H22N2O7/c17-6-9(19)3-1-2-8-5-16(14(22)15-13(8)21)12-4-10(20)11(7-18)23-12/h5,9-12,17-20H,1-4,6-7H2,(H,15,21,22)/t9?,10-,11+,12+/m0/s1

Molecular Properties:
- Polar Surface Area: 140.0 Ų
- LogP: -1.9