Glycoside
GD119323
Name:
Hydrachoside AFormula:
C27H34O12Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1CC(=O)CC(c2ccc(O)cc2)O1Aglycone:
C=CC1C(O)OC=C(C(=O)OC)C1CC1CC(=O)CC(c2ccc(O)cc2)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 8 |
| MolWt: | 550.56 | Num_heavy_atoms: | 39 |
| TPSA: | 181.44 | NumAromaticRings: | 1 |
Unique Aglycone
AD47786
Formula: C21H24O7
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1CC1CC(=O)CC(c2ccc(O)cc2)O1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 5 |
| MolWt: | 388.42 | Num_heavy_atoms: | 28 |
| TPSA: | 102.29 | NumAromaticRings: | 1 |
