Glycoside
GD155517
Name:
Cilistol QFormula:
C34H50O10Smiles:
CC(C1CC2(C)OC2(C)C(OC2OC(CO)C(O)C(O)C2O)O1)C1(O)CCC2C3CC=C4CC=CC(=O)C4(C)C3CCC21CAglycone:
CC(C1CC2(C)OC2(C)C(O)O1)C1(O)CCC2C3CC=C4CC=CC(=O)C4(C)C3CCC21CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.85 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 5 |
| MolWt: | 618.76 | Num_heavy_atoms: | 44 |
| TPSA: | 158.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD61689
Formula: C28H40O5
Smiles:
CC(C1CC2(C)OC2(C)C(O)O1)C1(O)CCC2C3CC=C4CC=CC(=O)C4(C)C3CCC21C| HBA: | 5 | RingCount: | 6 |
| HBD: | 2 | FractionCSP3: | 0.82 |
| AlogP: | 4.32 | Num_rotatable_bonds: | 2 |
| MolWt: | 456.62 | Num_heavy_atoms: | 33 |
| TPSA: | 79.29 | NumAromaticRings: | 0 |
