3-Hydroxypicolinic Acid
PubChem CID: 13401
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| Compound Synonyms | 3-HYDROXYPICOLINIC ACID, 874-24-8, 3-Hydroxypyridine-2-carboxylic acid, 3-Hydroxy-2-pyridinecarboxylic acid, 2-Pyridinecarboxylic acid, 3-hydroxy-, 3-HPA, MFCD00006294, CHEBI:64342, Pyridinecarboxylic acid, hydroxy-, XV7XP64JR5, EINECS 212-859-0, 116357-04-1, CHEMBL1234326, DTXSID80236320, 3-hydroxy-2-pyridine carboxylic acid, 3-Hydroxypicolinicacid, 3-Hydroxypicolinate, 3-Hydroxypicolinic acid, matrix substance for MALDI-MS, hydroxypicolinic acid, 3-hydroxylpicolinic acid, 3-hydroxy picolinic acid, 3-Hydroxy-picolinic acid, UNII-XV7XP64JR5, NCIOpen2_001249, SCHEMBL78249, 3-Hydroxy-2-pyridinecarboxylate, 3-hydroxypyridine-2-carboxylate, HY-Y0030A, DTXCID80158811, 3-Hydroxypyridinium-2-carboxylate, CS-D1114, HY-Y0030, BBL100164, BDBM50122011, STL227625, AKOS005170696, 3-Hydroxy-2-pyridinecarboxylic acid #, FH06201, PB46989, PS-3718, AC-26465, BP-12461, PD069985, SY017848, 3-Hydroxypyridine-2-carboxylic acid, 98%, DB-016012, CS-0899663, H0787, NS00014723, S6252, EN300-51029, C18620, 3-Hydroxypicolinic acid, purum, >=96.0% (T), AC-907/25014108, AF-399/40173370, Q10859486, Z608353738, 3-Hydroxypicolinic acid (3-Hydroxypyridine-2-carboxylic acid), 3-Hydroxypicolinic acid, matrix substance for MALDI-MS, >=99.0% (HPLC), 212-859-0, MHW |
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| Topological Polar Surface Area | 70.4 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 10.0 |
| Description | 3-Hydroxy picolinic acid is a picolinic acid derivative and is a member of the pyridine family. Picolinic acid is an isomer of nicotinic acid, which has the carboxyl side chain at the 3-position. It is a catabolite of the amino acid tryptophan. [HMDB] |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 137.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P14780, P22894, P03956, P08253, P15917, O42713, P08254, P09917, P29477, P14920, Q99489 |
| Iupac Name | 3-hydroxypyridine-2-carboxylic acid |
| Prediction Hob | 1.0 |
| Target Id | NPT645 |
| Xlogp | 1.3 |
| Molecular Formula | C6H5NO3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | BRARRAHGNDUELT-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -1.086 |
| Rotatable Bond Count | 1.0 |
| State | Solid |
| Logd | -0.137 |
| Synonyms | 3-Hydroxy-2-pyridinecarboxylate, 3-Hydroxy-2-pyridinecarboxylic acid, 3-Hydroxypicolinate, 3-Hydroxypyridine-2-carboxylate, 3-Hydroxypyridine-2-carboxylic acid, HPA |
| Compound Name | 3-Hydroxypicolinic Acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 139.027 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 139.027 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 139.11 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.8994819999999997 |
| Inchi | InChI=1S/C6H5NO3/c8-4-2-1-3-7-5(4)6(9)10/h1-3,8H,(H,9,10) |
| Smiles | C1=CC(=C(N=C1)C(=O)O)O |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Aloe Africana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 2. Outgoing r'ship
FOUND_INto/from Aloe Barbadensis (Plant) Rel Props:Source_db:npass_chem_all - 3. Outgoing r'ship
FOUND_INto/from Aloe Ferox (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 4. Outgoing r'ship
FOUND_INto/from Aloe Spicata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 5. Outgoing r'ship
FOUND_INto/from Aloe Vera (Plant) Rel Props:Source_db:cmaup_ingredients