Glycoside
GD012988
Name:
NoneFormula:
C26H29O6ClSmiles:
C#CCOCc1cc(Cl)c(Cc2ccc(CC)cc2)cc1[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
C#CCOCc1ccc(Cc2ccc(CC)cc2)c(Cl)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 8 |
| MolWt: | 460.95 | Num_heavy_atoms: | 32 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD09753
Formula: C20H19OCl
Smiles:
C#CCOCc1ccc(Cc2ccc(CC)cc2)c(Cl)c1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.26 |
| AlogP: | 4.64 | Num_rotatable_bonds: | 6 |
| MolWt: | 298.81 | Num_heavy_atoms: | 21 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
