Glycoside
GD027235
Name:
NoneFormula:
C21H32O13Smiles:
COCO[C@H]1[C@H](O[C@@H]2[C@H](CO)O[C@H](Oc3ccc(OC)cc3)[C@H](O)[C@H]2O)O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
COc1ccc(O)cc1Sugarmoiety:
CO.COCOC1C(OC2C(CO)OOC(O)C2O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | -2.67 | Num_rotatable_bonds: | 10 |
| MolWt: | 492.47 | Num_heavy_atoms: | 34 |
| TPSA: | 185.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD01111
Formula: C7H8O2
Smiles:
COc1ccc(O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 1 |
| MolWt: | 124.14 | Num_heavy_atoms: | 9 |
| TPSA: | 29.46 | NumAromaticRings: | 1 |
