Glycoside
GD123155
Name:
N-(2'-Beta-Glucopyranosyl-5'-Methoxysalicyl)-5-Hydroxyanthranilic Acid Me+Formula:
C22H25O11NSmiles:
COC(=O)c1cc(O)ccc1N=C(O)c1cc(OC)ccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COC(=O)c1cc(O)ccc1N=C(O)c1cc(OC)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.36 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 7 |
| MolWt: | 479.44 | Num_heavy_atoms: | 34 |
| TPSA: | 187.73 | NumAromaticRings: | 2 |
Unique Aglycone
AD49682
Formula: C16H15O6N
Smiles:
COC(=O)c1cc(O)ccc1N=C(O)c1cc(OC)ccc1O| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 2.53 | Num_rotatable_bonds: | 4 |
| MolWt: | 317.3 | Num_heavy_atoms: | 23 |
| TPSA: | 108.58 | NumAromaticRings: | 2 |
