Glycoside
GD009061
Name:
NoneFormula:
C27H41O16NSmiles:
CC(=O)N[C@H]1[C@H](O)[C@@H](O[C@@H]2O[C@H]([C@H](O)CO)[C@H](O)[C@H]2O)[C@@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)O[C@H]1OCc1ccccc1Aglycone:
OCc1ccccc1Sugarmoiety:
CC(=O)NC1C(O)OC(COC2OC(CO)C(O)C(O)C2O)C(OC2OC(C(O)CO)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.74 |
| AlogP: | -5.2 | Num_rotatable_bonds: | 12 |
| MolWt: | 635.62 | Num_heavy_atoms: | 44 |
| TPSA: | 266.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD00044
Formula: C7H8O
Smiles:
OCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
