Glycoside
GD021058
Name:
NoneFormula:
C22H33O11NSmiles:
CO[C@@H]1[C@H](O[C@@H]2[C@H](CO)O[C@H](OCc3ccccc3)[C@H](NC(C)=O)[C@H]2O)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
OCc1ccccc1Sugarmoiety:
COC1C(OC2C(CO)OC(O)C(NC(C)=O)C2O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.68 |
| AlogP: | -2.37 | Num_rotatable_bonds: | 9 |
| MolWt: | 487.5 | Num_heavy_atoms: | 34 |
| TPSA: | 176.4 | 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 |
