Glycoside
GD008892
Name:
ENGELETINFormula:
C21H24O9Smiles:
C[C@@H]1O[C@H](O[C@@H]2Cc3c(O)cc(O)cc3O[C@H]2c2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1ccc(C2Oc3cc(O)cc(O)c3CC2O)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 3 |
| MolWt: | 420.41 | Num_heavy_atoms: | 30 |
| TPSA: | 149.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD07043
Formula: C15H14O5
Smiles:
Oc1ccc(C2Oc3cc(O)cc(O)c3CC2O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.2 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 1 |
| MolWt: | 274.27 | Num_heavy_atoms: | 20 |
| TPSA: | 90.15 | NumAromaticRings: | 2 |
