Molecule ID: 121225510

IUPAC Name: 4-amino-5-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-[3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2-oxo-1,6-dihydropyrimidin-6-yl]pyrimidin-2-one

Description: The molecule is an N-glycosyl compound that is a metabolite produced by the bacterium Mycoplasma genitalium. It has a role as a Mycoplasma genitalium metabolite. It is a N-glycosyl compound, an aminopyrimidine, a pyrimidone and a ring assembly.

SMILES: CC1=CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(O)=NC1c1c(O)c(=N)nc(O)n1[C@H]1C[C@H](O)[C@@H](CO)O1

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

InChI: InChI=1S/C19H27N5O9/c1-7-4-23(12-2-8(27)10(5-25)32-12)18(30)21-14(7)15-16(29)17(20)22-19(31)24(15)13-3-9(28)11(6-26)33-13/h4,8-14,25-29H,2-3,5-6H2,1H3,(H,21,30)(H2,20,22,31)/t8-,9-,10+,11+,12+,13+,14?/m0/s1

Molecular Properties:
- Polar Surface Area: 211.0 Ų
- LogP: -3.1