Glycoside
GD019207
Name:
NoneFormula:
C17H24O9N2Smiles:
N[C@H](Cc1ccc(O)cc1)C(=O)NC(C(=O)O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
NC(Cc1ccc(O)cc1)C(=O)NCC(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.53 |
| AlogP: | -3.33 | Num_rotatable_bonds: | 7 |
| MolWt: | 400.38 | Num_heavy_atoms: | 28 |
| TPSA: | 202.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD05719
Formula: C11H14O4N2
Smiles:
NC(Cc1ccc(O)cc1)C(=O)NCC(=O)O| HBA: | 6 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 5 |
| MolWt: | 238.24 | Num_heavy_atoms: | 17 |
| TPSA: | 112.65 | NumAromaticRings: | 1 |
