Nicotinuric acid
AlkaPlorer ID: AK017582
Synonym: N-(3-Pyridinylcarbonyl)glycine, N-Nicotinoylglycine, 3-(Pyridylformamido)acetic acid
IUPAC Name: 2-(pyridine-3-carbonylamino)acetic acid
Structure
SMILES: O=C(O)CN=C(O)C1=CC=CN=C1
InChI: InChI=1S/C8H8N2O3/c11-7(12)5-10-8(13)6-2-1-3-9-4-6/h1-4H,5H2,(H,10,13)(H,11,12)
InChIKey: ZBSGKPYXQINNGF-UHFFFAOYSA-N
Reference
PubChem CID: 68499
CAS: 583-08-4
LOTUS: LTS0053138
SuperNatural Ⅲ: SN0466167
NPASS: NPC29702
COCONUT: CNP0229746
Source
Properties Information
Molecule Weight: 180.163
TPSA？: 82.78
MolLogP？: 0.4707999999999998
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Rattus norvegicus | Intestine | Drug metabolism | nan | None | 10.1021/acs.jmedchem.5b01961 |
| Rattus norvegicus | Liver | Drug metabolism | nan | None | 10.1021/acs.jmedchem.5b01961 |
| Rattus norvegicus | Peptidyl-glycine alpha-amidating monooxygenase | Activity | 0.7 | None | 10.1016/j.bmc.2008.10.013 |
| Rattus norvegicus | Peptidyl-glycine alpha-amidating monooxygenase | Km | 1900000.0 | nM | 10.1016/j.bmc.2008.10.013 |
| Rattus norvegicus | Peptidyl-glycine alpha-amidating monooxygenase | Ratio | 4.2 | 10'3/M/s | 10.1016/j.bmc.2008.10.013 |
| Rattus norvegicus | Peptidyl-glycine alpha-amidating monooxygenase | Vmax(app) | 8.0 | /s | 10.1016/j.bmc.2008.10.013 |
| Rattus norvegicus | Plasma | Drug metabolism | nan | None | 10.1021/acs.jmedchem.5b01961 |