Glycoside
GD122185
Name:
2-benzyl-4-hydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}benzoic acidFormula:
C20H22O9Smiles:
O=C(O)c1c(Cc2ccccc2)cc(O)cc1OC1OC(CO)C(O)C(O)C1OAglycone:
O=C(O)c1c(O)cc(O)cc1Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 406.39 | Num_heavy_atoms: | 29 |
| TPSA: | 156.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD49218
Formula: C14H12O4
Smiles:
O=C(O)c1c(O)cc(O)cc1Cc1ccccc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 244.25 | Num_heavy_atoms: | 18 |
| TPSA: | 77.76 | NumAromaticRings: | 2 |
