Glycoside
GD135911
Name:
5-hydroxy-2-(4-hydroxyphenyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-chromen-4-oneFormula:
C21H20O9Smiles:
O=c1cc(-c2ccc(O)cc2)oc2ccc(C3OC(CO)C(O)C(O)C3O)c(O)c12Aglycone:
O=c1cc(-c2ccc(O)cc2)oc2cccc(O)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 416.38 | Num_heavy_atoms: | 30 |
| TPSA: | 160.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD48580
Formula: C15H10O4
Smiles:
O=c1cc(-c2ccc(O)cc2)oc2cccc(O)c12| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 254.24 | Num_heavy_atoms: | 19 |
| TPSA: | 70.67 | NumAromaticRings: | 3 |
