Glycoside
GD147290
Name:
NoneFormula:
C38H48O19Smiles:
CC(C)=CCc1c(OC2CC(CO)C(O)C(O)C2O)cc(O)c2c(=O)c(OC3OC(C)C(O)C(O)C3OC3OC(O)C(O)C(O)C3O)c(-c3ccc(O)cc3)oc12Aglycone:
CC(C)=CCc1c(OC2CC(CO)C(O)C(O)C2O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12Sugarmoiety:
CC1OC(O)C(OC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 6 |
| HBD: | 12 | FractionCSP3: | 0.55 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 10 |
| MolWt: | 808.78 | Num_heavy_atoms: | 57 |
| TPSA: | 319.12 | NumAromaticRings: | 3 |
Unique Aglycone
AD58992
Formula: C27H30O10
Smiles:
CC(C)=CCc1c(OC2CC(CO)C(O)C(O)C2O)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.37 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 6 |
| MolWt: | 514.53 | Num_heavy_atoms: | 37 |
| TPSA: | 181.05 | NumAromaticRings: | 3 |
