Glycoside
GD134778
Name:
2-(hydroxymethyl)-6-{3-[2-(4-hydroxyphenyl)ethenyl]-5-methylphenoxy}oxane-3,4,5-triolFormula:
C21H24O7Smiles:
Cc1cc(C=Cc2ccc(O)cc2)cc(OC2OC(CO)C(O)C(O)C2O)c1Aglycone:
Cc1cc(O)cc(C=Cc2ccc(O)cc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 388.42 | Num_heavy_atoms: | 28 |
| TPSA: | 119.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD12946
Formula: C15H14O2
Smiles:
Cc1cc(O)cc(C=Cc2ccc(O)cc2)c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 3.58 | Num_rotatable_bonds: | 2 |
| MolWt: | 226.28 | Num_heavy_atoms: | 17 |
| TPSA: | 40.46 | NumAromaticRings: | 2 |
