Glycoside
GD040006
Name:
methyl 3-o-((7-carboxy) quinolin-2-yl)-methyl)-beta-d-galactopyranosideFormula:
C18H21O8NSmiles:
CO[C@H]1O[C@H](CO)[C@H](O)[C@H](OCc2ccc3ccc(C(=O)O)cc3n2)[C@@H]1OAglycone:
O=C(O)c1ccc2ccc(CO)nc2c1Sugarmoiety:
COC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 379.37 | Num_heavy_atoms: | 27 |
| TPSA: | 138.57 | NumAromaticRings: | 2 |
Unique Aglycone
AD23237
Formula: C11H9O3N
Smiles:
O=C(O)c1ccc2ccc(CO)nc2c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 203.2 | Num_heavy_atoms: | 15 |
| TPSA: | 70.42 | NumAromaticRings: | 2 |
