Glycoside
GD066900
Name:
NoneFormula:
C16H31O7N2Smiles:
CC(C)(C)OC(=O)N1CCC([NH2+][C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC1Aglycone:
CC(C)(C)OC(=O)N1CCC([NH3+])CC1Sugarmoiety:
OCC1OC(O)C([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.94 |
| AlogP: | -2.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 363.43 | Num_heavy_atoms: | 25 |
| TPSA: | 136.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD31977
Formula: C10H21O2N2
Smiles:
CC(C)(C)OC(=O)N1CCC([NH3+])CC1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 0 |
| MolWt: | 201.29 | Num_heavy_atoms: | 14 |
| TPSA: | 57.18 | NumAromaticRings: | 0 |
