Glycoside
GD151563
Name:
Cilistol P1Formula:
C35H56O12Smiles:
COC1(C)CC(C(C)C2(O)CCC3C4CC(O)C56CC5CC(=O)C6(C)C4CCC32C)OC(OC2OC(CO)C(O)C(O)C2O)C1(C)OAglycone:
CCC1(O)CCC2C3CC(O)C45CC4CC(=O)C5(C)C3CCC21CSugarmoiety:
COC1(C)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
AD58928
Formula: C21H32O3
Smiles:
CCC1(O)CCC2C3CC(O)C45CC4CC(=O)C5(C)C3CCC21C| HBA: | 3 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.95 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 332.48 | Num_heavy_atoms: | 24 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
