Glycoside
GD077265
Name:
Staphylionoside DFormula:
C19H30O8Smiles:
CC(=O)C=C=C1C(C)(C)C[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C[C@]1(C)OAglycone:
CC(=O)C=C=C1C(C)(C)CC(O)CC1(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.79 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 4 |
| MolWt: | 386.44 | Num_heavy_atoms: | 27 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD17280
Formula: C13H20O3
Smiles:
CC(=O)C=C=C1C(C)(C)CC(O)CC1(C)O| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.69 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 1 |
| MolWt: | 224.3 | Num_heavy_atoms: | 16 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
