Glycoside
GD035478
Name:
NoneFormula:
C33H52O10Smiles:
C=CCCC=CC=CC1CC(C)=C[C@H](OC)C[C@@H]2O[C@](O)(CC(O[C@@H]3O[C@H](C)[C@H](O)[C@H](OC)[C@H]3OC)[C@H]2C)[C@H](C)C(=O)O1Aglycone:
C=CCCC=CC=CC1CC(C)=CC(OC)CC2OC(O)(CC(O)C2C)C(C)C(=O)O1Sugarmoiety:
COC1C(O)OC(C)C(O)C1OCOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.73 |
| AlogP: | 4.0 | Num_rotatable_bonds: | 10 |
| MolWt: | 608.77 | Num_heavy_atoms: | 43 |
| TPSA: | 122.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD14052
Formula: C25H38O6
Smiles:
C=CCCC=CC=CC1CC(C)=CC(OC)CC2OC(O)(CC(O)C2C)C(C)C(=O)O1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | 3.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 434.57 | Num_heavy_atoms: | 31 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
