Glycoside
GD002428
Name:
NoneFormula:
C18H36O10N4Smiles:
C[C@H](O)[C@@H]1O[C@H](O[C@H]2[C@H](N)C[C@@H](N)[C@@H](O)[C@H]2O[C@@H]2O[C@H](CN)[C@H](O)[C@H]2O)[C@H](N)[C@H](O)[C@H]1OAglycone:
NC1CC(N)C(O)C(O)C1OSugarmoiety:
CC(O)C1OC(O)C(N)C(O)C1O.NCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 14 | FractionCSP3: | 1.0 |
| AlogP: | -6.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 468.5 | Num_heavy_atoms: | 32 |
| TPSA: | 262.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD00009
Formula: C6H14O3N2
Smiles:
NC1CC(N)C(O)C(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.87 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.19 | Num_heavy_atoms: | 11 |
| TPSA: | 112.73 | NumAromaticRings: | 0 |
