Glycoside
GD145204
Name:
2-(4-methoxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-oneFormula:
C22H24O9Smiles:
COc1ccc(C2CC(=O)c3ccc(OC4OC(CO)C(O)C(O)C4O)cc3O2)cc1Aglycone:
COc1ccc(C2CC(=O)c3ccc(O)cc3O2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 5 |
| MolWt: | 432.43 | Num_heavy_atoms: | 31 |
| TPSA: | 134.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD55542
Formula: C16H14O4
Smiles:
COc1ccc(C2CC(=O)c3ccc(O)cc3O2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.19 |
| AlogP: | 3.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 270.28 | Num_heavy_atoms: | 20 |
| TPSA: | 55.76 | NumAromaticRings: | 2 |
