Difference between revisions of "PWY-7571"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7014 CPD-7014] == * smiles: ** C=CC2(C(C)=C4(C=C9(C(C)C(CCC(=O)[O-])C5(=N([Mg]36(N1(=C(C(CC...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHENYLACETATE PHENYLACETATE] == * smiles: ** C1(=CC=C(C=C1)CC([O-])=O) * inchi key: ** InChIKey...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7014 CPD-7014] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHENYLACETATE PHENYLACETATE] ==
 
* smiles:
 
* smiles:
** C=CC2(C(C)=C4(C=C9(C(C)C(CCC(=O)[O-])C5(=N([Mg]36(N1(=C(C(CC)=C(C=O)C1=CC=2N34)C=C7(C(C)=C8(C(=O)[C-](C(OC)=O)C5=C(N67)8)))))9))))
+
** C1(=CC=C(C=C1)CC([O-])=O)
 +
* inchi key:
 +
** InChIKey=WLJVXDMOQOGPHL-UHFFFAOYSA-M
 
* common name:
 
* common name:
** chlorophyllide b
+
** phenylacetate
 
* molecular weight:
 
* molecular weight:
** 626.95    
+
** 135.142    
 
* Synonym(s):
 
* Synonym(s):
 +
** 2-phenylacetate
 +
** benzeneacetic acid
 +
** phenylacetic acid
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-7674]]
 
 
== 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-7673]]
+
* [[PHENDEHYD-RXN]]
 
== External links  ==
 
== External links  ==
 +
* CAS : 103-82-2
 +
* Wikipedia : Phenylacetic_acid
 +
* METABOLIGHTS : MTBLC18401
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658741 90658741]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=4409936 4409936]
* CHEBI:
+
* HMDB : HMDB00209
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58686 58686]
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C16541 C16541]
+
** [http://www.genome.jp/dbget-bin/www_bget?C07086 C07086]
{{#set: smiles=C=CC2(C(C)=C4(C=C9(C(C)C(CCC(=O)[O-])C5(=N([Mg]36(N1(=C(C(CC)=C(C=O)C1=CC=2N34)C=C7(C(C)=C8(C(=O)[C-](C(OC)=O)C5=C(N67)8)))))9))))}}
+
* CHEMSPIDER:
{{#set: common name=chlorophyllide b}}
+
** [http://www.chemspider.com/Chemical-Structure.3610724.html 3610724]
{{#set: molecular weight=626.95   }}
+
* CHEBI:
{{#set: consumed by=RXN-7674}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18401 18401]
{{#set: consumed or produced by=RXN-7673}}
+
* BIGG : pac
 +
{{#set: smiles=C1(=CC=C(C=C1)CC([O-])=O)}}
 +
{{#set: inchi key=InChIKey=WLJVXDMOQOGPHL-UHFFFAOYSA-M}}
 +
{{#set: common name=phenylacetate}}
 +
{{#set: molecular weight=135.142   }}
 +
{{#set: common name=2-phenylacetate|benzeneacetic acid|phenylacetic acid}}
 +
{{#set: consumed or produced by=PHENDEHYD-RXN}}

Revision as of 11:54, 18 January 2018

Metabolite PHENYLACETATE

  • smiles:
    • C1(=CC=C(C=C1)CC([O-])=O)
  • inchi key:
    • InChIKey=WLJVXDMOQOGPHL-UHFFFAOYSA-M
  • common name:
    • phenylacetate
  • molecular weight:
    • 135.142
  • Synonym(s):
    • 2-phenylacetate
    • benzeneacetic acid
    • phenylacetic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 103-82-2
  • Wikipedia : Phenylacetic_acid
  • METABOLIGHTS : MTBLC18401
  • PUBCHEM:
  • HMDB : HMDB00209
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • BIGG : pac
"C1(=CC=C(C=C1)CC([O-])=O)" cannot be used as a page name in this wiki.