Glycoside
GD157906
Name:
Dilobenol GFormula:
C37H48O15Smiles:
CC(C)=CCc1cc(C2Oc3c(CC=C(C)C)c(OC4OC(CO)C(O)C(O)C4O)cc(O)c3C(=O)C2OC2OC(C)C(O)C(O)C2O)ccc1OAglycone:
CC(C)=CCc1cc(C2Oc3c(CC=C(C)C)c(O)cc(O)c3C(=O)C2O)ccc1OSugarmoiety:
CC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.54 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 10 |
| MolWt: | 732.78 | Num_heavy_atoms: | 52 |
| TPSA: | 245.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD46584
Formula: C25H28O6
Smiles:
CC(C)=CCc1cc(C2Oc3c(CC=C(C)C)c(O)cc(O)c3C(=O)C2O)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 4.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 424.49 | Num_heavy_atoms: | 31 |
| TPSA: | 107.22 | NumAromaticRings: | 2 |
