Glycoside
GD014736
Name:
NoneFormula:
C36H62O19N4Smiles:
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OCC=CCOC(=O)NCCCOCCOCCOCCCNC(=O)OCC=CCO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1NC(C)=OAglycone:
O=C(NCCCOCCOCCOCCCNC(=O)OCC=CCO)OCC=CCOSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O.CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 23 | RingCount: | 2 |
| HBD: | 10 | FractionCSP3: | 0.78 |
| AlogP: | -3.7 | Num_rotatable_bonds: | 28 |
| MolWt: | 854.9 | Num_heavy_atoms: | 59 |
| TPSA: | 320.85 | NumAromaticRings: | 0 |
Unique Aglycone
AD10800
Formula: C20H36O9N2
Smiles:
O=C(NCCCOCCOCCOCCCNC(=O)OCC=CCO)OCC=CCO| HBA: | 11 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 20 |
| MolWt: | 448.51 | Num_heavy_atoms: | 31 |
| TPSA: | 144.81 | NumAromaticRings: | 0 |
