Molecule ID: 135403659

IUPAC Name: 2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-3H-pteridin-4-one

Description: The molecule is a biopterin in which the 1,2-dihydroxypropyl group has (1R,2S)-configuration; naturally occurring form. It is an enantiomer of a D-erythro-biopterin.

SMILES: C[C@H](O)[C@H](O)c1cnc2[nH]c(=N)nc(O)c2n1

SELFIES: [C][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C][=C][N][=C][NH1][C][=Branch1][C][=N][N][=C][Branch1][C][O][C][Ring1][Branch2][=N][Ring1][N]

InChI: InChI=1S/C9H11N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h2-3,6,15-16H,1H3,(H3,10,11,13,14,17)/t3-,6-/m0/s1

Molecular Properties:
- Polar Surface Area: 134.0 Ų
- LogP: -2.4