Difference between revisions of "ALLANTOATE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-397 CPD-397] == * smiles: ** C[S+](CCC([N+])C(=O)[O-])C * inchi key: ** InChIKey=YDBYJHTYSH...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ALLANTOATE ALLANTOATE] == * smiles: ** C(C(=O)[O-])(NC(=O)N)NC(=O)N * inchi key: ** InChIKey=NU...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-397 CPD-397] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ALLANTOATE ALLANTOATE] ==
 
* smiles:
 
* smiles:
** C[S+](CCC([N+])C(=O)[O-])C
+
** C(C(=O)[O-])(NC(=O)N)NC(=O)N
 
* inchi key:
 
* inchi key:
** InChIKey=YDBYJHTYSHBBAU-YFKPBYRVSA-O
+
** InChIKey=NUCLJNSWZCHRKL-UHFFFAOYSA-M
 
* common name:
 
* common name:
** S-methyl-L-methionine
+
** allantoate
 
* molecular weight:
 
* molecular weight:
** 164.242    
+
** 175.124    
 
* Synonym(s):
 
* Synonym(s):
** S-methylmethionine
+
** allantoic acid
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[MMUM-RXN]]
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* [[ALLANTOICASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[ALLANTOINASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 99-16-1
 +
* BIGG : 35164
 +
* DRUGBANK : DB04380
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7098638 7098638]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5287444 5287444]
* CHEBI:
+
* HMDB : HMDB01209
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58252 58252]
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* BIGG : 41336
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C03172 C03172]
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** [http://www.genome.jp/dbget-bin/www_bget?C00499 C00499]
{{#set: smiles=C[S+](CCC([N+])C(=O)[O-])C}}
+
* CHEMSPIDER:
{{#set: inchi key=InChIKey=YDBYJHTYSHBBAU-YFKPBYRVSA-O}}
+
** [http://www.chemspider.com/Chemical-Structure.4449824.html 4449824]
{{#set: common name=S-methyl-L-methionine}}
+
* CHEBI:
{{#set: molecular weight=164.242   }}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17536 17536]
{{#set: common name=S-methylmethionine}}
+
* METABOLIGHTS : MTBLC17536
{{#set: consumed by=MMUM-RXN}}
+
{{#set: smiles=C(C(=O)[O-])(NC(=O)N)NC(=O)N}}
 +
{{#set: inchi key=InChIKey=NUCLJNSWZCHRKL-UHFFFAOYSA-M}}
 +
{{#set: common name=allantoate}}
 +
{{#set: molecular weight=175.124   }}
 +
{{#set: common name=allantoic acid}}
 +
{{#set: consumed by=ALLANTOICASE-RXN}}
 +
{{#set: produced by=ALLANTOINASE-RXN}}

Latest revision as of 19:51, 21 March 2018

Metabolite ALLANTOATE

  • smiles:
    • C(C(=O)[O-])(NC(=O)N)NC(=O)N
  • inchi key:
    • InChIKey=NUCLJNSWZCHRKL-UHFFFAOYSA-M
  • common name:
    • allantoate
  • molecular weight:
    • 175.124
  • Synonym(s):
    • allantoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 99-16-1
  • BIGG : 35164
  • DRUGBANK : DB04380
  • PUBCHEM:
  • HMDB : HMDB01209
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC17536
"C(C(=O)[O-])(NC(=O)N)NC(=O)N" cannot be used as a page name in this wiki.