Glycoside
GD118538
Name:
5,7-dihydroxy-2-(4-hydroxy-2-methylphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-chromen-4-oneFormula:
C22H22O10Smiles:
Cc1cc(O)ccc1-c1cc(=O)c2c(O)cc(O)c(C3OC(CO)C(O)C(O)C3O)c2o1Aglycone:
Cc1cc(O)ccc1-c1cc(=O)c2c(O)cc(O)cc2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.32 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 446.41 | Num_heavy_atoms: | 32 |
| TPSA: | 181.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD47414
Formula: C16H12O5
Smiles:
Cc1cc(O)ccc1-c1cc(=O)c2c(O)cc(O)cc2o1| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 1 |
| MolWt: | 284.27 | Num_heavy_atoms: | 21 |
| TPSA: | 90.9 | NumAromaticRings: | 3 |
