Glycoside
GD122723
Name:
NoneFormula:
C22H20O12Smiles:
Cc1c(C(=O)O)c(O)cc2c1C(=O)c1c(O)cc(OC3OC(CO)C(O)C(O)C3O)cc1C2=OAglycone:
Cc1c(C(=O)O)c(O)cc2c1C(=O)c1c(O)cc(O)cc1C2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.32 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 4 |
| MolWt: | 476.39 | Num_heavy_atoms: | 34 |
| TPSA: | 211.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD49479
Formula: C16H10O7
Smiles:
Cc1c(C(=O)O)c(O)cc2c1C(=O)c1c(O)cc(O)cc1C2=O| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.06 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 1 |
| MolWt: | 314.25 | Num_heavy_atoms: | 23 |
| TPSA: | 132.13 | NumAromaticRings: | 2 |
