Glycoside
GD024406
Name:
NoneFormula:
C28H30O12Smiles:
COc1ccc(-c2oc3cc(OC)cc(OC)c3c(=O)c2O[C@@H]2O[C@H](C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2O)cc1Aglycone:
COc1ccc(-c2oc3cc(OC)cc(OC)c3c(=O)c2O)cc1Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.39 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 8 |
| MolWt: | 558.54 | Num_heavy_atoms: | 40 |
| TPSA: | 149.19 | NumAromaticRings: | 3 |
Unique Aglycone
AD16294
Formula: C18H16O6
Smiles:
COc1ccc(-c2oc3cc(OC)cc(OC)c3c(=O)c2O)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.32 | Num_heavy_atoms: | 24 |
| TPSA: | 78.13 | NumAromaticRings: | 3 |
