Glycoside
GD050352
Name:
NoneFormula:
C14H25O6N2Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)[C@H]1C[N@H+]2CC[C@@H]1CC2Aglycone:
NC(=O)C1C[NH+]2CCC1CC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | -4.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 317.36 | Num_heavy_atoms: | 22 |
| TPSA: | 123.69 | NumAromaticRings: | 0 |
Unique Aglycone
AD26603
Formula: C8H15ON2
Smiles:
NC(=O)C1C[NH+]2CCC1CC2| HBA: | 3 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 1 |
| MolWt: | 155.22 | Num_heavy_atoms: | 11 |
| TPSA: | 47.53 | NumAromaticRings: | 0 |
