Glycoside
GD000108
Name:
NoneFormula:
C31H50O10Smiles:
CC[C@@H]1OC(=O)C[C@H](O)[C@H](C)[C@@H]2OCC[C@H]2C[C@H](C)C(=O)C=CC(C)=C[C@H]1CO[C@@H]1O[C@H](C)[C@H](O)[C@H](OC)[C@H]1OCAglycone:
CCC1OC(=O)CC(O)C(C)C2OCCC2CC(C)C(=O)C=CC(C)=CC1COSugarmoiety:
COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.81 |
| AlogP: | 2.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 582.73 | Num_heavy_atoms: | 41 |
| TPSA: | 129.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD00135
Formula: C23H36O6
Smiles:
CCC1OC(=O)CC(O)C(C)C2OCCC2CC(C)C(=O)C=CC(C)=CC1CO| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.74 |
| AlogP: | 2.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 408.54 | Num_heavy_atoms: | 29 |
| TPSA: | 93.06 | NumAromaticRings: | 0 |
