Glycoside
GD059070
Name:
NoneFormula:
C12H18O8NPSmiles:
NC(=O)c1cccc([C@H]2O[C@@H](CO[PH](O)(O)O)[C@@H](O)[C@@H]2O)c1Aglycone:
CO[PH](O)(O)O.NC(=O)c1ccccc1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.42 |
| AlogP: | -1.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 335.25 | Num_heavy_atoms: | 22 |
| TPSA: | 162.7 | NumAromaticRings: | 1 |
Unique Aglycone
AD01413
Formula: C7H7ON
Smiles:
NC(=O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 1 |
| MolWt: | 121.14 | Num_heavy_atoms: | 9 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
AD01852
Formula: CH7O4P
Smiles:
CO[PH](O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 114.04 | Num_heavy_atoms: | 6 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
