Glycoside
GD150223
Name:
Mhpg GlucuronideFormula:
C15H20O10Smiles:
COc1cc(C(O)CO)ccc1OC1OC(C(=O)O)C(O)C(O)C1OAglycone:
COc1cc(C(O)CO)ccc1OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 360.31 | Num_heavy_atoms: | 25 |
| TPSA: | 166.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD51928
Formula: C9H12O4
Smiles:
COc1cc(C(O)CO)ccc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 184.19 | Num_heavy_atoms: | 13 |
| TPSA: | 69.92 | NumAromaticRings: | 1 |
