Glycoside
GD040002
Name:
6-{4-[2-(3,5-dihydroxyphenyl)ethenyl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C20H20O9Smiles:
O=C(O)[C@H]1O[C@H](Oc2ccc(C=Cc3cc(O)cc(O)c3)cc2)[C@@H](O)[C@@H](O)[C@H]1OAglycone:
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.25 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.37 | Num_heavy_atoms: | 29 |
| TPSA: | 156.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD01773
Formula: C14H12O3
Smiles:
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.97 | Num_rotatable_bonds: | 2 |
| MolWt: | 228.25 | Num_heavy_atoms: | 17 |
| TPSA: | 60.69 | NumAromaticRings: | 2 |
