Glycoside
GD120845
Name:
8-O-Methylretusin 7-O-LaminaribiosideFormula:
C29H34O15Smiles:
COc1ccc(-c2coc3c(OC)c(OC4OC(CO)C(O)C(OC5OC(CO)C(O)C(O)C5O)C4O)ccc3c2=O)cc1Aglycone:
COc1ccc(-c2coc3c(OC)c(O)ccc3c2=O)cc1Sugarmoiety:
OCC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.48 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 9 |
| MolWt: | 622.58 | Num_heavy_atoms: | 44 |
| TPSA: | 227.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD48590
Formula: C17H14O5
Smiles:
COc1ccc(-c2coc3c(OC)c(O)ccc3c2=O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 3.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.29 | Num_heavy_atoms: | 22 |
| TPSA: | 68.9 | NumAromaticRings: | 3 |
