Glycoside
GD142844
Name:
Cilistol PmFormula:
C35H56O12Smiles:
COC1CC2C3CCC(O)(C(C)C4CC(C)(O)C(C)(O)C(OC5OC(CO)C(O)C(O)C5O)O4)C3(C)CCC2C2(C)C(=O)CC3CC312Aglycone:
CCC1(O)CCC2C3CC(OC)C45CC4CC(=O)C5(C)C3CCC21CSugarmoiety:
CC1(O)CC(O)OC(OC2OC(CO)C(O)C(O)C2O)C1(C)OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.97 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 668.82 | Num_heavy_atoms: | 47 |
| TPSA: | 195.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD57473
Formula: C22H34O3
Smiles:
CCC1(O)CCC2C3CC(OC)C45CC4CC(=O)C5(C)C3CCC21C| HBA: | 3 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.95 |
| AlogP: | 3.97 | Num_rotatable_bonds: | 2 |
| MolWt: | 346.51 | Num_heavy_atoms: | 25 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
