Glycoside
GD083325
Name:
NoneFormula:
C22H29O6N2Smiles:
O=C(C[NH+](Cc1ccccc1)Cc1ccccc1)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
NC(=O)C[NH+](Cc1ccccc1)Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 8 |
| MolWt: | 417.48 | Num_heavy_atoms: | 30 |
| TPSA: | 123.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD37209
Formula: C16H19ON2
Smiles:
NC(=O)C[NH+](Cc1ccccc1)Cc1ccccc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.19 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 6 |
| MolWt: | 255.34 | Num_heavy_atoms: | 19 |
| TPSA: | 47.53 | NumAromaticRings: | 2 |
