Glycoside
GD146188
Name:
Pyrogallol-2-O-GlucuronideFormula:
C12H14O9Smiles:
O=C(O)C1OC(Oc2c(O)cccc2O)C(O)C(O)C1OAglycone:
Oc1cccc(O)c1OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -1.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 302.24 | Num_heavy_atoms: | 21 |
| TPSA: | 156.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD03511
Formula: C6H6O3
Smiles:
Oc1cccc(O)c1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 0 |
| MolWt: | 126.11 | Num_heavy_atoms: | 9 |
| TPSA: | 60.69 | NumAromaticRings: | 1 |
