Glycoside
GD114703
Name:
Cichorioside DFormula:
C27H38O13Smiles:
CC1=C2C(=O)C=C(COC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3O)C2C2OC(=O)C(C)C2CC1Aglycone:
CC1=C2C(=O)C=C(CO)C2C2OC(=O)C(C)C2CC1Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.78 |
| AlogP: | -1.93 | Num_rotatable_bonds: | 6 |
| MolWt: | 570.59 | Num_heavy_atoms: | 40 |
| TPSA: | 201.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD38080
Formula: C15H18O4
Smiles:
CC1=C2C(=O)C=C(CO)C2C2OC(=O)C(C)C2CC1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 1 |
| MolWt: | 262.31 | Num_heavy_atoms: | 19 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
