Glycoside
GD025971
Name:
YADANZIGANFormula:
C26H38O14Smiles:
CC1=C[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@]2(C)[C@H]1C[C@@H]1OC(=O)[C@H](O)[C@@]3(O)[C@@]14CO[C@]3(C)[C@H](O)[C@@H](O)[C@H]42Aglycone:
CC1=CC(O)C(O)C2(C)C1CC1OC(=O)C(O)C3(O)C4(C)OCC13C2C(O)C4OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 9 | FractionCSP3: | 0.88 |
| AlogP: | -4.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 574.58 | Num_heavy_atoms: | 40 |
| TPSA: | 236.06 | NumAromaticRings: | 0 |
Unique Aglycone
AD17160
Formula: C20H28O9
Smiles:
CC1=CC(O)C(O)C2(C)C1CC1OC(=O)C(O)C3(O)C4(C)OCC13C2C(O)C4O| HBA: | 9 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.85 |
| AlogP: | -2.16 | Num_rotatable_bonds: | 0 |
| MolWt: | 412.44 | Num_heavy_atoms: | 29 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
