Glycoside
GD138416
Name:
4,5,6,7-tetrakis(acetyloxy)-2-benzylhept-2-enoic acidFormula:
C22H26O10Smiles:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(C=C(Cc1ccccc1)C(=O)O)OC(C)=OAglycone:
C=C(Cc1ccccc1)C(=O)OSugarmoiety:
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(O)OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.41 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 11 |
| MolWt: | 450.44 | Num_heavy_atoms: | 32 |
| TPSA: | 142.5 | NumAromaticRings: | 1 |
Unique Aglycone
AD55871
Formula: C10H10O2
Smiles:
C=C(Cc1ccccc1)C(=O)O| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 162.19 | Num_heavy_atoms: | 12 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
