Glycoside
GD008314
Name:
NoneFormula:
C24H31O11ClSmiles:
O=C(C=COC[C@@H]1OC(O)[C@H](O)[C@H](O)[C@H]1O)CCCCC(=O)OCC(O)COc1ccc(Cl)cc1Aglycone:
COC=CC(=O)CCCCC(=O)OCC(O)COc1ccc(Cl)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 14 |
| MolWt: | 518.94 | Num_heavy_atoms: | 35 |
| TPSA: | 172.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD06650
Formula: C19H23O6Cl
Smiles:
COC=CC(=O)CCCCC(=O)OCC(O)COc1ccc(Cl)cc1| HBA: | 6 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.44 |
| AlogP: | 2.91 | Num_rotatable_bonds: | 12 |
| MolWt: | 370.83 | Num_heavy_atoms: | 25 |
| TPSA: | 82.06 | NumAromaticRings: | 1 |
