Glycoside
GD148765
Name:
Phlogacanthoside AFormula:
C26H38O9Smiles:
CC1=C2C(CC3=C(CCC4C(C)(COC5OC(CO)C(O)C(O)C5O)CCCC34C)C2O)OC1=OAglycone:
CC1=C2C(CC3=C(CCC4C(C)(CO)CCCC34C)C2O)OC1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 494.58 | Num_heavy_atoms: | 35 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD58526
Formula: C20H28O4
Smiles:
CC1=C2C(CC3=C(CCC4C(C)(CO)CCCC34C)C2O)OC1=O| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 1 |
| MolWt: | 332.44 | Num_heavy_atoms: | 24 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
