Glycoside
GD134974
Name:
MedininFormula:
C32H50O13Smiles:
C=C1CCC2C(C)(COC3OC(CO)C(OC4OC(CO)C(O)C(O)C4O)C(O)C3O)CCCC2(C)C1CCC1=CC(=O)OC1Aglycone:
C=C1CCC2C(C)(CO)CCCC2(C)C1CCC1=CC(=O)OC1Sugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.84 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 10 |
| MolWt: | 642.74 | Num_heavy_atoms: | 45 |
| TPSA: | 204.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD54600
Formula: C20H30O3
Smiles:
C=C1CCC2C(C)(CO)CCCC2(C)C1CCC1=CC(=O)OC1| HBA: | 3 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 4.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.46 | Num_heavy_atoms: | 23 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
