Glycoside
GD053629
Name:
NoneFormula:
C16H27O6N2Smiles:
O=C(C(=O)N1CC2(CC[N@@H+](CC3CC3)C2)C1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
C1CC1C[NH+]1CCC2(CNC2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | -3.84 | Num_rotatable_bonds: | 7 |
| MolWt: | 343.4 | Num_heavy_atoms: | 24 |
| TPSA: | 122.74 | NumAromaticRings: | 0 |
Unique Aglycone
AD27361
Formula: C10H19N2
Smiles:
C1CC1C[NH+]1CCC2(CNC2)C1| HBA: | 2 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 2 |
| MolWt: | 167.28 | Num_heavy_atoms: | 12 |
| TPSA: | 16.47 | NumAromaticRings: | 0 |
