Glycoside
GD031857
Name:
NoneFormula:
C41H56O19Smiles:
CC(=O)O[C@H](CCCC=CC=CC=CC=CC=Cc1ccc(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](C)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)cc1)C(=O)OAglycone:
CC(=O)OC(CCCC=CC=CC=CC=CC=Cc1ccc(O)cc1)C(=O)OSugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.56 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 19 |
| MolWt: | 852.88 | Num_heavy_atoms: | 60 |
| TPSA: | 301.05 | NumAromaticRings: | 1 |
Unique Aglycone
AD18470
Formula: C23H26O5
Smiles:
CC(=O)OC(CCCC=CC=CC=CC=CC=Cc1ccc(O)cc1)C(=O)O| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 4.82 | Num_rotatable_bonds: | 11 |
| MolWt: | 382.46 | Num_heavy_atoms: | 28 |
| TPSA: | 83.83 | NumAromaticRings: | 1 |