Glycoside
GD053843
Name:
NoneFormula:
C15H27O6N2Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)[C@@H]1CCC[N@H+]1CC1CC1Aglycone:
NC(=O)C1CCC[NH+]1CC1CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | -3.64 | Num_rotatable_bonds: | 5 |
| MolWt: | 331.39 | Num_heavy_atoms: | 23 |
| TPSA: | 123.69 | NumAromaticRings: | 0 |
Unique Aglycone
AD27440
Formula: C9H17ON2
Smiles:
NC(=O)C1CCC[NH+]1CC1CC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.89 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 169.25 | Num_heavy_atoms: | 12 |
| TPSA: | 47.53 | NumAromaticRings: | 0 |
