Difference between revisions of "Ec-26 001060"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PROPIONATE PROPIONATE] == * smiles: ** CCC(=O)[O-] * inchi key: ** InChIKey=XBDQKXXYIPTUBI-UHFF...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SORBITOL SORBITOL] == * smiles: ** C(C(C(C(C(CO)O)O)O)O)O * inchi key: ** InChIKey=FBPFZTCFMRRE...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PROPIONATE PROPIONATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SORBITOL SORBITOL] ==
 
* smiles:
 
* smiles:
** CCC(=O)[O-]
+
** C(C(C(C(C(CO)O)O)O)O)O
 
* inchi key:
 
* inchi key:
** InChIKey=XBDQKXXYIPTUBI-UHFFFAOYSA-M
+
** InChIKey=FBPFZTCFMRRESA-JGWLITMVSA-N
 
* common name:
 
* common name:
** propanoate
+
** D-sorbitol
 
* molecular weight:
 
* molecular weight:
** 73.071    
+
** 182.173    
 
* Synonym(s):
 
* Synonym(s):
** propionic acid
+
** L-gulitol
** ethylformic acid
+
** D-glucitol
** methylacetic acid
+
** meglumine
** propionate
+
** iso-sorbide
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== 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-14727]]
+
* [[RXN-7644]]
 
== External links  ==
 
== External links  ==
* CAS : 79-09-4
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* CAS : 50-70-4
* BIGG : 34098
+
* BIGG : 36018
 +
* DRUGBANK : DB01638
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=104745 104745]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5780 5780]
* HMDB : HMDB00237
+
* HMDB : HMDB00247
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C00163 C00163]
+
** [http://www.genome.jp/dbget-bin/www_bget?C00794 C00794]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.94556.html 94556]
+
** [http://www.chemspider.com/Chemical-Structure.5576.html 5576]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17272 17272]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17924 17924]
* METABOLIGHTS : MTBLC17272
+
* METABOLIGHTS : MTBLC17924
{{#set: smiles=CCC(=O)[O-]}}
+
{{#set: smiles=C(C(C(C(C(CO)O)O)O)O)O}}
{{#set: inchi key=InChIKey=XBDQKXXYIPTUBI-UHFFFAOYSA-M}}
+
{{#set: inchi key=InChIKey=FBPFZTCFMRRESA-JGWLITMVSA-N}}
{{#set: common name=propanoate}}
+
{{#set: common name=D-sorbitol}}
{{#set: molecular weight=73.071   }}
+
{{#set: molecular weight=182.173   }}
{{#set: common name=propionic acid|ethylformic acid|methylacetic acid|propionate}}
+
{{#set: common name=L-gulitol|D-glucitol|meglumine|iso-sorbide}}
{{#set: reversible reaction associated=RXN-14727}}
+
{{#set: reversible reaction associated=RXN-7644}}

Revision as of 13:30, 21 March 2018

Metabolite SORBITOL

  • smiles:
    • C(C(C(C(C(CO)O)O)O)O)O
  • inchi key:
    • InChIKey=FBPFZTCFMRRESA-JGWLITMVSA-N
  • common name:
    • D-sorbitol
  • molecular weight:
    • 182.173
  • Synonym(s):
    • L-gulitol
    • D-glucitol
    • meglumine
    • iso-sorbide

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 50-70-4
  • BIGG : 36018
  • DRUGBANK : DB01638
  • PUBCHEM:
  • HMDB : HMDB00247
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC17924