Glycoside
GD120046
Name:
Agamenoside JFormula:
C33H54O10Smiles:
CC1CC(C2(O)OC3CC4C5CCC6CC(O)CCC6(C)C5CCC4(C)C3C2C)OC1OC1OC(CO)C(O)C(O)C1OAglycone:
CC1CC(C2(O)OC3CC4C5CCC6CC(O)CCC6(C)C5CCC4(C)C3C2C)OC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 4 |
| MolWt: | 610.79 | Num_heavy_atoms: | 43 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD48179
Formula: C27H44O5
Smiles:
CC1CC(C2(O)OC3CC4C5CCC6CC(O)CCC6(C)C5CCC4(C)C3C2C)OC1O| HBA: | 5 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 4.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 448.64 | Num_heavy_atoms: | 32 |
| TPSA: | 79.15 | NumAromaticRings: | 0 |
