Glycoside
GD024853
Name:
FAROBIN AFormula:
C27H30O14Smiles:
C[C@@H]1O[C@H](c2c(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc3oc(-c4ccc(O)c(O)c4)cc(=O)c3c2O)C[C@H](O)[C@H]1OAglycone:
CC1OC(c2c(O)cc3oc(-c4ccc(O)c(O)c4)cc(=O)c3c2O)CC(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.44 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 578.52 | Num_heavy_atoms: | 41 |
| TPSA: | 239.97 | NumAromaticRings: | 3 |
Unique Aglycone
AD16543
Formula: C21H20O9
Smiles:
CC1OC(c2c(O)cc3oc(-c4ccc(O)c(O)c4)cc(=O)c3c2O)CC(O)C1O| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | 1.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 416.38 | Num_heavy_atoms: | 30 |
| TPSA: | 160.82 | NumAromaticRings: | 3 |
