Molecule ID: 135867731

IUPAC Name: (2-amino-7-hydroxy-4-oxo-6-sulfanyl-3,5,5a,8,9a,10-hexahydropyrano[3,2-g]pteridin-8-yl)methyl dihydrogen phosphate

Description: The molecule is an organic heterotricyclic compound consisting of a pyran ring fused to a pteridine ring system. It is an organic heterotricyclic compound, an organonitrogen heterocyclic compound and an oxacycle.

SMILES: N=c1nc(O)c2c([nH]1)NC1OC(COP(=O)(O)O)C(O)=C(S)C1N2

SELFIES: [N][=C][N][=C][Branch1][C][O][C][=C][Branch1][Ring2][NH1][Ring1][#Branch1][N][C][O][C][Branch1][O][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][Branch1][C][O][=C][Branch1][C][S][C][Ring1][=C][N][Ring2][Ring1][Ring1]

InChI: InChI=1S/C10H14N5O7PS/c11-10-14-7-4(8(17)15-10)12-3-6(24)5(16)2(22-9(3)13-7)1-21-23(18,19)20/h2-3,9,12,16,24H,1H2,(H2,18,19,20)(H4,11,13,14,15,17)

Molecular Properties:
- Polar Surface Area: 189.0 Ų
- LogP: -3.4