Glycoside
GD014971
Name:
NoneFormula:
C24H31O10NSmiles:
CC(=O)OC[C@@H]1O[C@H](OC(C)=O)[C@H](NC(=O)CCCc2ccccc2)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
COC(C)=O.NC(=O)CCCc1ccccc1Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.54 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 10 |
| MolWt: | 493.51 | Num_heavy_atoms: | 35 |
| TPSA: | 143.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD00017
Formula: C3H6O2
Smiles:
COC(C)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.67 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 0 |
| MolWt: | 74.08 | Num_heavy_atoms: | 5 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
AD10951
Formula: C10H13ON
Smiles:
NC(=O)CCCc1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 4 |
| MolWt: | 163.22 | Num_heavy_atoms: | 12 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
