Glycoside
GD082475
Name:
NoneFormula:
C20H31O7N2Smiles:
COc1cccc(CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)[C@H]2CC[C@H]([NH3+])CC2)c1Aglycone:
COc1cccc(CNC2CCC([NH3+])CC2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.6 |
| AlogP: | -1.78 | Num_rotatable_bonds: | 9 |
| MolWt: | 411.48 | Num_heavy_atoms: | 29 |
| TPSA: | 155.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD37057
Formula: C14H23ON2
Smiles:
COc1cccc(CNC2CCC([NH3+])CC2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 235.35 | Num_heavy_atoms: | 17 |
| TPSA: | 48.9 | NumAromaticRings: | 1 |
