Glycoside
GD086137
Name:
NoneFormula:
C22H22O8Smiles:
COC(=O)[C@H](OC(=O)c1ccc(C)cc1)[C@@H](OC(=O)c1ccc(C)cc1)C(=O)OCAglycone:
Cc1ccc(C=O)cc1.Cc1ccc(C=O)cc1Sugarmoiety:
COC(=O)C(OO)C(OO)C(=O)OCOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.27 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 414.41 | Num_heavy_atoms: | 30 |
| TPSA: | 105.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD01408
Formula: C8H8O
Smiles:
Cc1ccc(C=O)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 1 |
| MolWt: | 120.15 | Num_heavy_atoms: | 9 |
| TPSA: | 17.07 | NumAromaticRings: | 1 |
