Glycoside
GD105777
Name:
NoneFormula:
C26H34O13N2Smiles:
CC(=O)N[C@@H]1[C@H](O[C@@H]2[C@H](CO)O[C@H](Oc3ccc4c(C)cc(=O)oc4c3)[C@H](NC(C)=O)[C@@H]2O)O[C@H](CO)[C@H](O)[C@@H]1OAglycone:
Cc1cc(=O)oc2cc(O)ccc12Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2NC(C)=O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -2.61 | Num_rotatable_bonds: | 8 |
| MolWt: | 582.56 | Num_heavy_atoms: | 41 |
| TPSA: | 226.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD00685
Formula: C10H8O3
Smiles:
Cc1cc(=O)oc2cc(O)ccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 0 |
| MolWt: | 176.17 | Num_heavy_atoms: | 13 |
| TPSA: | 50.44 | NumAromaticRings: | 2 |
