Glycoside
GD120633
Name:
2-{[(2,3,4-trihydroxyoxolan-2-yl)methyl]amino}benzoic acidFormula:
C12H15O6NSmiles:
O=C(O)c1ccccc1NCC1(O)OCC(O)C1OAglycone:
CNc1ccccc1C(=O)OSugarmoiety:
OC1COC(O)(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 269.25 | Num_heavy_atoms: | 19 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD00255
Formula: C8H9O2N
Smiles:
CNc1ccccc1C(=O)O| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 151.16 | Num_heavy_atoms: | 11 |
| TPSA: | 49.33 | NumAromaticRings: | 1 |
