Glycoside
GD057838
Name:
NoneFormula:
C15H29O6N2Smiles:
C[NH+](C)C[C@H]1CC[C@@H](NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)CC1Aglycone:
C[NH+](C)CC1CCC(N)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.87 |
| AlogP: | -3.55 | Num_rotatable_bonds: | 8 |
| MolWt: | 333.41 | Num_heavy_atoms: | 23 |
| TPSA: | 131.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD29018
Formula: C9H21N2
Smiles:
C[NH+](C)CC1CCC(N)CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 157.28 | Num_heavy_atoms: | 11 |
| TPSA: | 30.46 | NumAromaticRings: | 0 |
