Glycoside
GD064204
Name:
NoneFormula:
C16H28O7N2Smiles:
CC[C@H]1CCN(CC(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)C1=OAglycone:
CCC1CCN(CC(=O)NCCO)C1=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 7 |
| MolWt: | 360.41 | Num_heavy_atoms: | 25 |
| TPSA: | 128.56 | NumAromaticRings: | 0 |
Unique Aglycone
AD30894
Formula: C10H18O3N2
Smiles:
CCC1CCN(CC(=O)NCCO)C1=O| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 214.26 | Num_heavy_atoms: | 15 |
| TPSA: | 69.64 | NumAromaticRings: | 0 |
