Glycoside
GD158385
Name:
Suspensolide EFormula:
C23H36O13Smiles:
CC(=O)OCC1(O)C(O)CC2C(COC3OC(CO)C(O)C(O)C3O)=COC(OC(=O)CC(C)C)C21Aglycone:
CC(=O)OCC1(O)C(O)CC2C(CO)=COC(OC(=O)CC(C)C)C21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.83 |
| AlogP: | -2.08 | Num_rotatable_bonds: | 9 |
| MolWt: | 520.53 | Num_heavy_atoms: | 36 |
| TPSA: | 201.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD44856
Formula: C17H26O8
Smiles:
CC(=O)OCC1(O)C(O)CC2C(CO)=COC(OC(=O)CC(C)C)C21| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.76 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 358.39 | Num_heavy_atoms: | 25 |
| TPSA: | 122.52 | NumAromaticRings: | 0 |
