Glycoside
GD115490
Name:
NoneFormula:
C13H20O9Smiles:
CC1OC(O)C(CC2OC(C(=O)O)=CC(O)C2O)C(O)C1OAglycone:
CC1OC(C(=O)O)=CC(O)C1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.77 |
| AlogP: | -2.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 320.29 | Num_heavy_atoms: | 22 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD45696
Formula: C7H10O5
Smiles:
CC1OC(C(=O)O)=CC(O)C1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 1 |
| MolWt: | 174.15 | Num_heavy_atoms: | 12 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
