Glycoside
GD145987
Name:
Cichorioside JFormula:
C21H26O10Smiles:
C=C1CCC2C1C13OCC2(O)C=CC1=C(COC1OC(CO)C(O)C(O)C1O)C(=O)O3Aglycone:
C=C1CCC2C1C13OCC2(O)C=CC1=C(CO)C(=O)O3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 4 |
| MolWt: | 438.43 | Num_heavy_atoms: | 31 |
| TPSA: | 155.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD58568
Formula: C15H16O5
Smiles:
C=C1CCC2C1C13OCC2(O)C=CC1=C(CO)C(=O)O3| HBA: | 5 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.53 |
| AlogP: | 0.44 | Num_rotatable_bonds: | 1 |
| MolWt: | 276.29 | Num_heavy_atoms: | 20 |
| TPSA: | 75.99 | NumAromaticRings: | 0 |
