Glycoside
GD032253
Name:
NoneFormula:
C24H36O7Smiles:
CCOC1CC(O)(CCC2=C(C)C(=O)C(O)=C3C(C)(C)[C@H](OC(C)=O)CC[C@]23C)CO1Aglycone:
CCC1=C(C)C(=O)C(O)=C2C1(C)CCC(OC(C)=O)C2(C)CSugarmoiety:
CCOC1CC(O)(O)CO1Other Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | 3.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 436.55 | Num_heavy_atoms: | 31 |
| TPSA: | 102.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD20700
Formula: C18H26O4
Smiles:
CCC1=C(C)C(=O)C(O)=C2C1(C)CCC(OC(C)=O)C2(C)C| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | 3.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 306.4 | Num_heavy_atoms: | 22 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
