Difference between revisions of "STEARIC ACID"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=STEARIC_ACID STEARIC_ACID] == * smiles: ** CCCCCCCCCCCCCCCCCC(=O)[O-] * inchi key: ** InChIKey=...")
 
Line 3: Line 3:
 
* smiles:
 
* smiles:
 
** CCCCCCCCCCCCCCCCCC(=O)[O-]
 
** CCCCCCCCCCCCCCCCCC(=O)[O-]
 +
* molecular weight:
 +
** 283.473   
 
* inchi key:
 
* inchi key:
 
** InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-M
 
** InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-M
 
* common name:
 
* common name:
 
** stearate
 
** stearate
* molecular weight:
 
** 283.473   
 
 
* Synonym(s):
 
* Synonym(s):
 
** octadecanoate (n-C18:0)
 
** octadecanoate (n-C18:0)
Line 23: Line 23:
 
* [[LONG-CHAIN-ALCOHOL-DEHYDROGENASE-RXN-CPD-7873/NAD/WATER//STEARIC_ACID/NADH/PROTON.45.]]
 
* [[LONG-CHAIN-ALCOHOL-DEHYDROGENASE-RXN-CPD-7873/NAD/WATER//STEARIC_ACID/NADH/PROTON.45.]]
 
== External links  ==
 
== External links  ==
* CAS : 57-11-4
 
 
* METABOLIGHTS : MTBLC25629
 
* METABOLIGHTS : MTBLC25629
* PUBCHEM:
+
* BIGG : ocdca
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3033836 3033836]
+
* CAS : 57-11-4
 
* HMDB : HMDB00827
 
* HMDB : HMDB00827
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C01530 C01530]
 
 
* CHEMSPIDER:
 
* CHEMSPIDER:
 
** [http://www.chemspider.com/Chemical-Structure.2298422.html 2298422]
 
** [http://www.chemspider.com/Chemical-Structure.2298422.html 2298422]
 
* CHEBI:
 
* CHEBI:
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=25629 25629]
 
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=25629 25629]
* BIGG : ocdca
+
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C01530 C01530]
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3033836 3033836]
 
{{#set: smiles=CCCCCCCCCCCCCCCCCC(=O)[O-]}}
 
{{#set: smiles=CCCCCCCCCCCCCCCCCC(=O)[O-]}}
 +
{{#set: molecular weight=283.473    }}
 
{{#set: inchi key=InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-M}}
 
{{#set: inchi key=InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-M}}
 
{{#set: common name=stearate}}
 
{{#set: common name=stearate}}
{{#set: molecular weight=283.473    }}
 
 
{{#set: common name=octadecanoate (n-C18:0)|stearic acid|octadecanoic acid}}
 
{{#set: common name=octadecanoate (n-C18:0)|stearic acid|octadecanoic acid}}
 
{{#set: consumed by=RXN-11820-STEARIC_ACID/HYDROGEN-PEROXIDE//R-2-HYDROXYSTEARATE/WATER.58.|RXN-16380}}
 
{{#set: consumed by=RXN-11820-STEARIC_ACID/HYDROGEN-PEROXIDE//R-2-HYDROXYSTEARATE/WATER.58.|RXN-16380}}
 
{{#set: produced by=RXN-1602-CPD-17271/WATER//CPD66-43/STEARIC_ACID/PROTON.46.|RXN-9548}}
 
{{#set: produced by=RXN-1602-CPD-17271/WATER//CPD66-43/STEARIC_ACID/PROTON.46.|RXN-9548}}
 
{{#set: reversible reaction associated=LONG-CHAIN-ALCOHOL-DEHYDROGENASE-RXN-CPD-7873/NAD/WATER//STEARIC_ACID/NADH/PROTON.45.}}
 
{{#set: reversible reaction associated=LONG-CHAIN-ALCOHOL-DEHYDROGENASE-RXN-CPD-7873/NAD/WATER//STEARIC_ACID/NADH/PROTON.45.}}

Latest revision as of 16:42, 9 January 2019

Metabolite STEARIC_ACID

  • smiles:
    • CCCCCCCCCCCCCCCCCC(=O)[O-]
  • molecular weight:
    • 283.473
  • inchi key:
    • InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-M
  • common name:
    • stearate
  • Synonym(s):
    • octadecanoate (n-C18:0)
    • stearic acid
    • octadecanoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • METABOLIGHTS : MTBLC25629
  • BIGG : ocdca
  • CAS : 57-11-4
  • HMDB : HMDB00827
  • CHEMSPIDER:
  • CHEBI:
  • LIGAND-CPD:
  • PUBCHEM:
"CCCCCCCCCCCCCCCCCC(=O)[O-" cannot be used as a page name in this wiki.