Glycoside
GD023551
Name:
PATRIRIDOSIDE HFormula:
C21H32O11Smiles:
C=C1CO[C@]2(CO[C@@H]3O[C@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)[C@H](O)[C@H](O)[C@H]3O)C(C)=CC[C@H]12Aglycone:
C=C1COC2(CO)C(C)=CCC12Sugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.81 |
| AlogP: | -2.44 | Num_rotatable_bonds: | 7 |
| MolWt: | 460.48 | Num_heavy_atoms: | 32 |
| TPSA: | 167.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD15828
Formula: C10H14O2
Smiles:
C=C1COC2(CO)C(C)=CCC12| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 166.22 | Num_heavy_atoms: | 12 |
| TPSA: | 29.46 | NumAromaticRings: | 0 |
