Glycoside
GD006990
Name:
ANTIRRHINOSIDEFormula:
C15H22O10Smiles:
C[C@@]12O[C@H]1[C@H](O)[C@]1(O)C=CO[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]12Aglycone:
CC12OC1C(O)C1(O)C=COC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.87 |
| AlogP: | -3.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 362.33 | Num_heavy_atoms: | 25 |
| TPSA: | 161.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD05723
Formula: C9H12O5
Smiles:
CC12OC1C(O)C1(O)C=COC(O)C12| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.78 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 0 |
| MolWt: | 200.19 | Num_heavy_atoms: | 14 |
| TPSA: | 82.45 | NumAromaticRings: | 0 |
