Glycoside
GD133369
Name:
4-Hydroxypyridyl-3-Oic Acid 4-O-GlucopyranosideFormula:
C12H15O8NSmiles:
O=C(O)c1cnccc1OC1OC(CO)C(O)C(O)C1OAglycone:
O=C(O)c1cnccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.04 | Num_rotatable_bonds: | 4 |
| MolWt: | 301.25 | Num_heavy_atoms: | 21 |
| TPSA: | 149.57 | NumAromaticRings: | 1 |
Unique Aglycone
AD53984
Formula: C6H5O3N
Smiles:
O=C(O)c1cnccc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.11 | Num_heavy_atoms: | 10 |
| TPSA: | 70.42 | NumAromaticRings: | 1 |
