Difference between revisions of "RXN-14286"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHE PHE] == * smiles: ** C([O-])(=O)C([N+])CC1(C=CC=CC=1) * inchi key: ** InChIKey=COLNVLDHVKWL...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-941 CPD-941] == * smiles: ** CCC(C(SCCC(CCCCC(N)=O)S)=O)C * inchi key: ** InChIKey=UFNCWFSS...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHE PHE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-941 CPD-941] ==
 
* smiles:
 
* smiles:
−
** C([O-])(=O)C([N+])CC1(C=CC=CC=1)
+
** CCC(C(SCCC(CCCCC(N)=O)S)=O)C
 
* inchi key:
 
* inchi key:
−
** InChIKey=COLNVLDHVKWLRT-QMMMGPOBSA-N
+
** InChIKey=UFNCWFSSEGPJNL-UHFFFAOYSA-N
 
* common name:
 
* common name:
−
** L-phenylalanine
+
** S-(2-methylbutanoyl)-dihydrolipoamide
 
* molecular weight:
 
* molecular weight:
−
** 165.191    
+
** 291.466    
 
* Synonym(s):
 
* Synonym(s):
−
** 2S-α-phenylalanine
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** S-(2-methylbutyryl)dihydrolipoamide
−
** F
+
−
** endophenyl
+
−
** phenylalanine
+
−
** phe
+
−
** L-phe
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RME144]]
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* [[DHRT_2mbcoa]]
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* [[PHENYLALANINE--TRNA-LIGASE-RXN]]
+
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[RXN-10814]]
 
−
* [[PHEAMINOTRANS-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 63-91-2
 
−
* METABOLIGHTS : MTBLC58095
 
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6925665 6925665]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=440565 440565]
−
* HMDB : HMDB00159
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* HMDB : HMDB06869
 
* LIGAND-CPD:
 
* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C00079 C00079]
+
** [http://www.genome.jp/dbget-bin/www_bget?C05118 C05118]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.389465.html 389465]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58095 58095]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28692 28692]
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* BIGG : phe__L
+
* METABOLIGHTS : MTBLC28692
−
{{#set: smiles=C([O-])(=O)C([N+])CC1(C=CC=CC=1)}}
+
{{#set: smiles=CCC(C(SCCC(CCCCC(N)=O)S)=O)C}}
−
{{#set: inchi key=InChIKey=COLNVLDHVKWLRT-QMMMGPOBSA-N}}
+
{{#set: inchi key=InChIKey=UFNCWFSSEGPJNL-UHFFFAOYSA-N}}
−
{{#set: common name=L-phenylalanine}}
+
{{#set: common name=S-(2-methylbutanoyl)-dihydrolipoamide}}
−
{{#set: molecular weight=165.191   }}
+
{{#set: molecular weight=291.466   }}
−
{{#set: common name=2S-α-phenylalanine|F|endophenyl|phenylalanine|phe|L-phe}}
+
{{#set: common name=S-(2-methylbutyryl)dihydrolipoamide}}
−
{{#set: consumed by=RME144|PHENYLALANINE--TRNA-LIGASE-RXN}}
+
{{#set: consumed by=DHRT_2mbcoa}}
−
{{#set: consumed or produced by=RXN-10814|PHEAMINOTRANS-RXN}}
+

Revision as of 19:51, 18 March 2018

Metabolite CPD-941

  • smiles:
    • CCC(C(SCCC(CCCCC(N)=O)S)=O)C
  • inchi key:
    • InChIKey=UFNCWFSSEGPJNL-UHFFFAOYSA-N
  • common name:
    • S-(2-methylbutanoyl)-dihydrolipoamide
  • molecular weight:
    • 291.466
  • Synonym(s):
    • S-(2-methylbutyryl)dihydrolipoamide

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=RXN-14286&oldid=27341"