Glycoside
GD034739
Name:
NoneFormula:
C21H22O6Smiles:
COc1ccc(C#Cc2ccc(OC)c([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2)cc1Aglycone:
COc1ccc(C#Cc2ccc(OC)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 370.4 | Num_heavy_atoms: | 27 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD21832
Formula: C16H14O2
Smiles:
COc1ccc(C#Cc2ccc(OC)cc2)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 3.1 | Num_rotatable_bonds: | 2 |
| MolWt: | 238.29 | Num_heavy_atoms: | 18 |
| TPSA: | 18.46 | NumAromaticRings: | 2 |
