Glycoside
GD118057
Name:
5-O-Methyleriodictyol 7-Glucosyl-(1->4)-GalactosideFormula:
C28H34O16Smiles:
COc1cc(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)cc2c1C(=O)CC(c1ccc(O)c(O)c1)O2Aglycone:
COc1cc(O)cc2c1C(=O)CC(c1ccc(O)c(O)c1)O2Sugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.54 |
| AlogP: | -2.18 | Num_rotatable_bonds: | 8 |
| MolWt: | 626.56 | Num_heavy_atoms: | 44 |
| TPSA: | 254.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD46955
Formula: C16H14O6
Smiles:
COc1cc(O)cc2c1C(=O)CC(c1ccc(O)c(O)c1)O2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.19 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 302.28 | Num_heavy_atoms: | 22 |
| TPSA: | 96.22 | NumAromaticRings: | 2 |
