Glycoside
GD057813
Name:
NoneFormula:
C15H27O7N2Smiles:
[NH3+][C@H]1CC[C@H](N(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)C2COC2)CC1Aglycone:
[NH3+]C1CCC(NC2COC2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.87 |
| AlogP: | -3.59 | Num_rotatable_bonds: | 7 |
| MolWt: | 347.39 | Num_heavy_atoms: | 24 |
| TPSA: | 155.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD29011
Formula: C9H19ON2
Smiles:
[NH3+]C1CCC(NC2COC2)CC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | -0.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 171.26 | Num_heavy_atoms: | 12 |
| TPSA: | 48.9 | NumAromaticRings: | 0 |
