Glycoside
GD129440
Name:
5-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C23H26O11Smiles:
COc1c(O)c2c(c(C3OC(CO)C(O)C(O)C3O)c1OC)OC(c1ccc(O)cc1)CC2=OAglycone:
COc1cc2c(c(O)c1OC)C(=O)CC(c1ccc(O)cc1)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 478.45 | Num_heavy_atoms: | 34 |
| TPSA: | 175.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD52437
Formula: C17H16O6
Smiles:
COc1cc2c(c(O)c1OC)C(=O)CC(c1ccc(O)cc1)O2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 2.82 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.31 | Num_heavy_atoms: | 23 |
| TPSA: | 85.22 | NumAromaticRings: | 2 |
