Glycoside
GD037826
Name:
(2r,3r)-4-anilino-2,3-dihydroxy-4-oxobutanoic acidFormula:
C10H11O5NSmiles:
O=C(Nc1ccccc1)[C@@H](O)[C@@H](O)C(=O)OAglycone:
Nc1ccccc1Sugarmoiety:
O=C(O)C(O)C(O)C(=O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.2 |
| AlogP: | -0.57 | Num_rotatable_bonds: | 4 |
| MolWt: | 225.2 | Num_heavy_atoms: | 16 |
| TPSA: | 106.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD11089
Formula: C6H7N
Smiles:
Nc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 0 |
| MolWt: | 93.13 | Num_heavy_atoms: | 7 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
