Difference between revisions of "NIACINE"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=NIACINE NIACINE] == * smiles: ** C1(=CC=C(C([O-])=O)C=N1) * common name: ** nicotinate * inchi...") |
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* smiles: | * smiles: | ||
** C1(=CC=C(C([O-])=O)C=N1) | ** C1(=CC=C(C([O-])=O)C=N1) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 122.103 | ** 122.103 | ||
| + | * inchi key: | ||
| + | ** InChIKey=PVNIIMVLHYAWGP-UHFFFAOYSA-M | ||
| + | * common name: | ||
| + | ** nicotinate | ||
* Synonym(s): | * Synonym(s): | ||
** 3-pyridinecarboxylic acid | ** 3-pyridinecarboxylic acid | ||
| Line 29: | Line 29: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
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| − | |||
| − | |||
* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.912.html 912] | ** [http://www.chemspider.com/Chemical-Structure.912.html 912] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=937 937] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=32544 32544] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=32544 32544] | ||
| + | * GO-TERMS : (REFMET "Nicotinic acid" NIL midford 3701443689 NIL NIL) | ||
| + | * CAS : 59-67-6 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C00253 C00253] | ||
| + | * HMDB : HMDB01488 | ||
* METABOLIGHTS : MTBLC32544 | * METABOLIGHTS : MTBLC32544 | ||
| + | * BIGG : nac | ||
{{#set: smiles=C1(=CC=C(C([O-])=O)C=N1)}} | {{#set: smiles=C1(=CC=C(C([O-])=O)C=N1)}} | ||
| − | |||
| − | |||
{{#set: molecular weight=122.103 }} | {{#set: molecular weight=122.103 }} | ||
| + | {{#set: inchi key=InChIKey=PVNIIMVLHYAWGP-UHFFFAOYSA-M}} | ||
| + | {{#set: common name=nicotinate}} | ||
{{#set: common name=3-pyridinecarboxylic acid|nicotinic acid|wampocap|nicolar|nicocap|nicobid|nico-400-|nicamin|niacin|niacine|vitamin B3|3-pyridinecarboxylate|pyridine-3-carboxylate}} | {{#set: common name=3-pyridinecarboxylic acid|nicotinic acid|wampocap|nicolar|nicocap|nicobid|nico-400-|nicamin|niacin|niacine|vitamin B3|3-pyridinecarboxylate|pyridine-3-carboxylate}} | ||
{{#set: consumed by=NICOTINATEPRIBOSYLTRANS-RXN}} | {{#set: consumed by=NICOTINATEPRIBOSYLTRANS-RXN}} | ||
Latest revision as of 11:51, 10 January 2019
Contents
Metabolite NIACINE
- smiles:
- C1(=CC=C(C([O-])=O)C=N1)
- molecular weight:
- 122.103
- inchi key:
- InChIKey=PVNIIMVLHYAWGP-UHFFFAOYSA-M
- common name:
- nicotinate
- Synonym(s):
- 3-pyridinecarboxylic acid
- nicotinic acid
- wampocap
- nicolar
- nicocap
- nicobid
- nico-400-
- nicamin
- niacin
- niacine
- vitamin B3
- 3-pyridinecarboxylate
- pyridine-3-carboxylate
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- PUBCHEM:
- CHEBI:
- GO-TERMS : (REFMET "Nicotinic acid" NIL midford 3701443689 NIL NIL)
- CAS : 59-67-6
- LIGAND-CPD:
- HMDB : HMDB01488
- METABOLIGHTS : MTBLC32544
- BIGG : nac
"C1(=CC=C(C([O-])=O)C=N1)" cannot be used as a page name in this wiki.
