Glycoside
GD008441
Name:
NoneFormula:
C44H76O19N8Smiles:
CC(=O)N[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H](CO)O[C@H]1O[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)CAglycone:
CC(NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(=O)NC(C(=O)NC(C(=O)O)C(C)C)C(C)CSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 27 | RingCount: | 3 |
| HBD: | 15 | FractionCSP3: | 0.82 |
| AlogP: | -6.01 | Num_rotatable_bonds: | 23 |
| MolWt: | 1021.13 | Num_heavy_atoms: | 71 |
| TPSA: | 416.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD06741
Formula: C30H53O9N7
Smiles:
CC(NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(=O)NC(C(=O)NC(C(=O)O)C(C)C)C(C)C| HBA: | 16 | RingCount: | 1 |
| HBD: | 9 | FractionCSP3: | 0.77 |
| AlogP: | -1.8 | Num_rotatable_bonds: | 16 |
| MolWt: | 655.79 | Num_heavy_atoms: | 46 |
| TPSA: | 249.36 | NumAromaticRings: | 0 |
