Glycoside
GD151042
Name:
NoneFormula:
C40H59O14ClSmiles:
COC1C=C(C)CC(C=CC#CC2CC2Cl)OC(=O)C(C)C2(O)CC(OC3OC(C)C(OC4OC(C)C(O)C(C)(O)C4O)C(C)(O)C3O)C(C)C(O2)C1CAglycone:
COC1C=C(C)CC(C=CC#CC2CC2Cl)OC(=O)C(C)C2(O)CC(O)C(C)C(O2)C1CSugarmoiety:
CC1OC(OC2C(C)OC(O)C(O)C2(C)O)C(O)C(C)(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.82 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 6 |
| MolWt: | 787.34 | Num_heavy_atoms: | 54 |
| TPSA: | 203.06 | NumAromaticRings: | 0 |
Unique Aglycone
AD52689
Formula: C26H35O6Cl
Smiles:
COC1C=C(C)CC(C=CC#CC2CC2Cl)OC(=O)C(C)C2(O)CC(O)C(C)C(O2)C1C| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.72 |
| AlogP: | 3.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 467.0 | Num_heavy_atoms: | 32 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
