Glycoside
GD132854
Name:
Cilistol UFormula:
C34H52O11Smiles:
CC(C1CC2(C)OC2(C)C(OC2OC(CO)C(O)C(O)C2O)O1)C1(O)CCC2C3CC(O)C45CC4CC(=O)C5(C)C3CCC21CAglycone:
CC(C1CC2(C)OC2(C)C(O)O1)C1(O)CCC2C3CC(O)C45CC4CC(=O)C5(C)C3CCC21CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 8 |
| HBD: | 6 | FractionCSP3: | 0.97 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 636.78 | Num_heavy_atoms: | 45 |
| TPSA: | 178.67 | NumAromaticRings: | 0 |
Unique Aglycone
AD53785
Formula: C28H42O6
Smiles:
CC(C1CC2(C)OC2(C)C(O)O1)C1(O)CCC2C3CC(O)C45CC4CC(=O)C5(C)C3CCC21C| HBA: | 6 | RingCount: | 7 |
| HBD: | 3 | FractionCSP3: | 0.96 |
| AlogP: | 3.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 474.64 | Num_heavy_atoms: | 34 |
| TPSA: | 99.52 | NumAromaticRings: | 0 |
