Glycoside
GD063086
Name:
NoneFormula:
C16H28O7N2Smiles:
CC(C)(CO)CN1CC2(C1)CN(C(=O)[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O)C2Aglycone:
CC(C)(CO)CN1CC2(CN(C=O)C2)C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | -3.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 360.41 | Num_heavy_atoms: | 25 |
| TPSA: | 133.93 | NumAromaticRings: | 0 |
Unique Aglycone
AD30413
Formula: C11H20O2N2
Smiles:
CC(C)(CO)CN1CC2(CN(C=O)C2)C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.91 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 4 |
| MolWt: | 212.29 | Num_heavy_atoms: | 15 |
| TPSA: | 43.78 | NumAromaticRings: | 0 |
