 |
| Ligand Name: alpha-ketopimelic acid |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB310 |
PubChem:
86962
|
Synonym(s):
- 2-oxoheptanedioic acid
- 17126-90-8
- 2-oxopimelic acid
- 2-ketopimelic acid
- 2-oxoheptanedionic acid
- 2-oxopimelate
- 2-ketoheptanedionic acid
- 2-oxo-heptanedioic acid
- alpha-ketoheptanedionic acid
- chembl185075
- chebi:72700
- heptanedioic acid, oxo-
- a-ketopimelinsaure
- einecs 241-191-2
- acmc-20chda
- schembl259198
- dtxsid30169053
- zinc2508023
- bdbm50160721
- akos006272625
- 2-ketopimelic acid, >=90.0% (qnmr)
- 95027-53-5
- db-043859
- ft-0637501
- c16588
- q27140085
show 25 synonym(s)
|
| DrugBank: - |
ChEMBL: CHEMBL185075 |
| Canonical SMILES: OC(=O)CCCCC(=O)C(O)=O |
| Standard InChI: InChI=1S/C7H10O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-4H2,(H,9,10)(H,11,12) |
| Molecular Formula: C7H10O5 |
Mol. Weight: 174.05283 |
logP: 0.2851 |
| HBD: 2 | HBA: 3 |
| #Rotatable Bonds: 6 | TPSA: 91.67 |