Difference between revisions of "Tiso gene 14586"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=L-SELENOCYSTEINE L-SELENOCYSTEINE] == * smiles: ** C([Se])C([N+])C([O-])=O * inchi key: ** InCh...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ITACONATE ITACONATE] == * smiles: ** C=C(C(=O)[O-])CC([O-])=O * inchi key: ** InChIKey=LVHBHZAN...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=L-SELENOCYSTEINE L-SELENOCYSTEINE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ITACONATE ITACONATE] ==
 
* smiles:
 
* smiles:
−
** C([Se])C([N+])C([O-])=O
+
** C=C(C(=O)[O-])CC([O-])=O
 
* inchi key:
 
* inchi key:
−
** InChIKey=ZKZBPNGNEQAJSX-REOHCLBHSA-N
+
** InChIKey=LVHBHZANLOWSRM-UHFFFAOYSA-L
 
* common name:
 
* common name:
−
** L-selenocysteine
+
** itaconate
 
* molecular weight:
 
* molecular weight:
−
** 168.054    
+
** 128.084    
 
* Synonym(s):
 
* Synonym(s):
−
** U
+
** propylenedicarboxylic acid
 +
** methylenebutanedioic acid
 +
** 2-propene-1,2-dicarboxylic acid
 +
** methylenesuccinic acid
 +
** itaconic acid
 +
** 2-methylsuccinate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-12728]]
+
* [[RXN-8988]]
−
* [[SUCHMSSELCYSLh]]
+
−
* [[ACHMSSELCYSL]]
+
−
* [[ACHMSSELCYSLh]]
+
−
* [[SUCHMSSELCYSL]]
+
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-12726]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 97-65-4
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5459996 5459996]
 +
* HMDB : HMDB02092
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C05688 C05688]
+
** [http://www.genome.jp/dbget-bin/www_bget?C00490 C00490]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.4573697.html 4573697]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57843 57843]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17240 17240]
−
* METABOLIGHTS : MTBLC57843
+
* METABOLIGHTS : MTBLC17240
−
* PUBCHEM:
+
{{#set: smiles=C=C(C(=O)[O-])CC([O-])=O}}
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245418 25245418]
+
{{#set: inchi key=InChIKey=LVHBHZANLOWSRM-UHFFFAOYSA-L}}
−
* HMDB : HMDB03288
+
{{#set: common name=itaconate}}
−
{{#set: smiles=C([Se])C([N+])C([O-])=O}}
+
{{#set: molecular weight=128.084   }}
−
{{#set: inchi key=InChIKey=ZKZBPNGNEQAJSX-REOHCLBHSA-N}}
+
{{#set: common name=propylenedicarboxylic acid|methylenebutanedioic acid|2-propene-1,2-dicarboxylic acid|methylenesuccinic acid|itaconic acid|2-methylsuccinate}}
−
{{#set: common name=L-selenocysteine}}
+
{{#set: consumed by=RXN-8988}}
−
{{#set: molecular weight=168.054   }}
+
−
{{#set: common name=U}}
+
−
{{#set: consumed by=RXN-12728|SUCHMSSELCYSLh|ACHMSSELCYSL|ACHMSSELCYSLh|SUCHMSSELCYSL}}
+
−
{{#set: produced by=RXN-12726}}
+

Revision as of 19:33, 18 March 2018

Metabolite ITACONATE

  • smiles:
    • C=C(C(=O)[O-])CC([O-])=O
  • inchi key:
    • InChIKey=LVHBHZANLOWSRM-UHFFFAOYSA-L
  • common name:
    • itaconate
  • molecular weight:
    • 128.084
  • Synonym(s):
    • propylenedicarboxylic acid
    • methylenebutanedioic acid
    • 2-propene-1,2-dicarboxylic acid
    • methylenesuccinic acid
    • itaconic acid
    • 2-methylsuccinate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 97-65-4
  • PUBCHEM:
  • HMDB : HMDB02092
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC17240
"C=C(C(=O)[O-])CC([O-])=O" cannot be used as a page name in this wiki.



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