Glycoside
GD055799
Name:
NoneFormula:
C13H21O9NSmiles:
O=C(N[C@@H]1COCCC12OCCO2)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
NC1COCCC12OCCO2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.85 |
| AlogP: | -3.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 335.31 | Num_heavy_atoms: | 23 |
| TPSA: | 154.78 | NumAromaticRings: | 0 |
Unique Aglycone
AD28144
Formula: C7H13O3N
Smiles:
NC1COCCC12OCCO2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 0 |
| MolWt: | 159.18 | Num_heavy_atoms: | 11 |
| TPSA: | 53.71 | NumAromaticRings: | 0 |
