Glycoside
GD023550
Name:
PATRIRIDOSIDE GFormula:
C16H24O7Smiles:
C=C1CO[C@]2(CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)C(C)=CC[C@H]12Aglycone:
C=C1COC2(CO)C(C)=CCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -0.91 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.36 | Num_heavy_atoms: | 23 |
| TPSA: | 108.61 | 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 |
