Glycoside

GD038299
Name:
8-oxo-guanosine-5'-triphosphateFormula:
C10H16O15N5P3Smiles:
Nc1nc2c([nH]c(=O)n2[C@H]2O[C@H](CO[P@](=O)(O)O[P@](=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1Aglycone:
COP(=O)(O)OP(=O)(O)OP(=O)(O)O.Nc1nc2[nH]c(=O)[nH]c2c(=O)[nH]1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 20 | RingCount: | 3 |
HBD: | 10 | FractionCSP3: | 0.5 |
AlogP: | -3.04 | Num_rotatable_bonds: | 8 |
MolWt: | 539.18 | Num_heavy_atoms: | 33 |
TPSA: | 319.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD00534
Formula: CH7O10P3
Smiles:
COP(=O)(O)OP(=O)(O)OP(=O)(O)OHBA: | 10 | RingCount: | 0 |
HBD: | 4 | FractionCSP3: | 1.0 |
AlogP: | -0.04 | Num_rotatable_bonds: | 5 |
MolWt: | 271.98 | Num_heavy_atoms: | 14 |
TPSA: | 159.82 | NumAromaticRings: | 0 |
AD18815
Formula: C5H5O2N5
Smiles:
Nc1nc2[nH]c(=O)[nH]c2c(=O)[nH]1HBA: | 7 | RingCount: | 2 |
HBD: | 5 | FractionCSP3: | 0.0 |
AlogP: | -1.48 | Num_rotatable_bonds: | 0 |
MolWt: | 167.13 | Num_heavy_atoms: | 12 |
TPSA: | 120.42 | NumAromaticRings: | 2 |