Glycoside
GD123828
Name:
2,3-DiketogulonateFormula:
C6H8O7Smiles:
O=C(O)C(=O)C(=O)C(O)C(O)COAglycone:
O=CC(=O)OSugarmoiety:
O=C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -3.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 192.12 | Num_heavy_atoms: | 13 |
| TPSA: | 132.13 | NumAromaticRings: | 0 |
Unique Aglycone
AD49993
Formula: C2H2O3
Smiles:
O=CC(=O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 1 |
| MolWt: | 74.03 | Num_heavy_atoms: | 5 |
| TPSA: | 54.37 | NumAromaticRings: | 0 |
