Difference between revisions of "RXN-10617"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12258 CPD-12258] == * smiles: ** CC(C(=O)NC(C(=O)[O-])CCC(=O)NC(CCCC[N+])C(NC(C)C(=O)[O-])=...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=STEARIC_ACID STEARIC_ACID] == * smiles: ** CCCCCCCCCCCCCCCCCC(=O)[O-] * common name: ** stearat...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12258 CPD-12258] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=STEARIC_ACID STEARIC_ACID] ==
 
* smiles:
 
* smiles:
−
** CC(C(=O)NC(C(=O)[O-])CCC(=O)NC(CCCC[N+])C(NC(C)C(=O)[O-])=O)NC(=O)C(C)OC1(C(O)C(CO)OC(C(NC(=O)C)1)OP(OP(OCC2(OC(C(O)C(O)2)N3(C=CC(=O)NC(=O)3)))([O-])=O)([O-])=O)
+
** CCCCCCCCCCCCCCCCCC(=O)[O-]
−
* inchi key:
+
−
** InChIKey=FOEDSVRZGQIXSP-XSOIKTQOSA-K
+
 
* common name:
 
* common name:
−
** UDP-N-acetyl-α-D-muramoyl-L-alanyl-γ-D-glutamyl-L-lysyl-D-alanine
+
** stearate
 +
* inchi key:
 +
** InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-M
 
* molecular weight:
 
* molecular weight:
−
** 1075.843    
+
** 283.473    
 
* Synonym(s):
 
* Synonym(s):
−
** UDP-Mur2Ac(oyl-L-Ala-g-D-Glu-L-Lys-D-Ala)
+
** octadecanoate (n-C18:0)
−
** UDP-MurNAc-tetrapeptide
+
** stearic acid
 +
** octadecanoic acid
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-11347]]
+
* [[RXN-11820-STEARIC_ACID/HYDROGEN-PEROXIDE//R-2-HYDROXYSTEARATE/WATER.58.]]
 +
* [[RXN-16380]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-9624]]
 +
* [[LPLPS1AGPE180]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 57-11-4
 +
* BIGG : ocdca
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658175 90658175]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3033836 3033836]
 +
* HMDB : HMDB00827
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C06432 C06432]
+
** [http://www.genome.jp/dbget-bin/www_bget?C01530 C01530]
−
{{#set: smiles=CC(C(=O)NC(C(=O)[O-])CCC(=O)NC(CCCC[N+])C(NC(C)C(=O)[O-])=O)NC(=O)C(C)OC1(C(O)C(CO)OC(C(NC(=O)C)1)OP(OP(OCC2(OC(C(O)C(O)2)N3(C=CC(=O)NC(=O)3)))([O-])=O)([O-])=O)}}
+
* CHEMSPIDER:
−
{{#set: inchi key=InChIKey=FOEDSVRZGQIXSP-XSOIKTQOSA-K}}
+
** [http://www.chemspider.com/Chemical-Structure.2298422.html 2298422]
−
{{#set: common name=UDP-N-acetyl-α-D-muramoyl-L-alanyl-γ-D-glutamyl-L-lysyl-D-alanine}}
+
* CHEBI:
−
{{#set: molecular weight=1075.843   }}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=25629 25629]
−
{{#set: common name=UDP-Mur2Ac(oyl-L-Ala-g-D-Glu-L-Lys-D-Ala)|UDP-MurNAc-tetrapeptide}}
+
* METABOLIGHTS : MTBLC25629
−
{{#set: consumed by=RXN-11347}}
+
{{#set: smiles=CCCCCCCCCCCCCCCCCC(=O)[O-]}}
 +
{{#set: common name=stearate}}
 +
{{#set: inchi key=InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-M}}
 +
{{#set: molecular weight=283.473   }}
 +
{{#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: produced by=RXN-9624|LPLPS1AGPE180}}

Revision as of 16:31, 21 March 2018

Metabolite STEARIC_ACID

  • smiles:
    • CCCCCCCCCCCCCCCCCC(=O)[O-]
  • common name:
    • stearate
  • inchi key:
    • InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-M
  • molecular weight:
    • 283.473
  • 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

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




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