Glycoside
GD014345
Name:
NoneFormula:
C19H38O11N4Smiles:
C[C@H](N)[C@@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](N)C[C@@H](N)[C@H]2O[C@@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H](O)[C@H]2N)[C@H](O)[C@H]1OAglycone:
NC1CC(N)C(O)C(O)C1OSugarmoiety:
CC(N)C1OC(O)C(O)C1O.NC1C(O)OC(C(O)CO)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 15 | FractionCSP3: | 1.0 |
| AlogP: | -6.9 | Num_rotatable_bonds: | 7 |
| MolWt: | 498.53 | Num_heavy_atoms: | 34 |
| TPSA: | 282.61 | 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 |
