Glycoside
GD035482
Name:
NoneFormula:
C26H38O10Smiles:
C[C@]1(C(=O)O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)CCC[C@]2(C)[C@H](CCC3=CCOC3=O)C(CO)=CC[C@H]12Aglycone:
CC1(C(=O)O)CCCC2(C)C(CCC3=CCOC3=O)C(CO)=CCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.77 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 7 |
| MolWt: | 510.58 | Num_heavy_atoms: | 36 |
| TPSA: | 162.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD22443
Formula: C20H28O5
Smiles:
CC1(C(=O)O)CCCC2(C)C(CCC3=CCOC3=O)C(CO)=CCC12| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.7 |
| AlogP: | 3.09 | Num_rotatable_bonds: | 5 |
| MolWt: | 348.44 | Num_heavy_atoms: | 25 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
