Glycoside
GD028121
Name:
NoneFormula:
C33H50O11Smiles:
CC=CCC(C)=C[C@@H]1OC(=O)C[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OC)[C@H]2O)C=CC[C@H](OC)C(C)=C[C@H](C)C[C@@H]2C=C[C@H]1OO2Aglycone:
CC=CCC(C)=CC1OC(=O)CC(O)C=CCC(OC)C(C)=CC(C)CC2C=CC1OO2Sugarmoiety:
COC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | 3.24 | Num_rotatable_bonds: | 8 |
| MolWt: | 622.75 | Num_heavy_atoms: | 44 |
| TPSA: | 142.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD18410
Formula: C26H38O6
Smiles:
CC=CCC(C)=CC1OC(=O)CC(O)C=CCC(OC)C(C)=CC(C)CC2C=CC1OO2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 4.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 446.58 | Num_heavy_atoms: | 32 |
| TPSA: | 74.22 | NumAromaticRings: | 0 |
