Glycoside
GD039203
Name:
glutamol-ampFormula:
C15H22O9N6PSmiles:
Nc1ncnc2c1ncn2[C@H]1O[C@H](CO[P@](=O)([O-])OC[C@@H]([NH3+])CCC(=O)[O-])[C@H](O)[C@@H]1OAglycone:
COP(=O)([O-])OCC([NH3+])CCC(=O)[O-].Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.6 |
| AlogP: | -4.33 | Num_rotatable_bonds: | 10 |
| MolWt: | 461.35 | Num_heavy_atoms: | 31 |
| TPSA: | 245.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD24308
Formula: C6H13O6NP
Smiles:
COP(=O)([O-])OCC([NH3+])CCC(=O)[O-]| HBA: | 7 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.83 |
| AlogP: | -2.74 | Num_rotatable_bonds: | 7 |
| MolWt: | 226.14 | Num_heavy_atoms: | 14 |
| TPSA: | 126.36 | NumAromaticRings: | 0 |
