Difference between revisions of "PWY-7277"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HISTIDINAL HISTIDINAL] == * smiles: ** C1(NC=NC=1CC([CH]=O)[N+]) * inchi key: ** InChIKey=VYOIE...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD3O-4151 CPD3O-4151] == * smiles: ** C1(C(=CC=C(C=1)O)CCO) * common name: ** 4-tyrosol * inch...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HISTIDINAL HISTIDINAL] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD3O-4151 CPD3O-4151] ==
 
* smiles:
 
* smiles:
** C1(NC=NC=1CC([CH]=O)[N+])
+
** C1(C(=CC=C(C=1)O)CCO)
* inchi key:
+
** InChIKey=VYOIELONWKIZJS-YFKPBYRVSA-O
+
 
* common name:
 
* common name:
** histidinal
+
** 4-tyrosol
 +
* inchi key:
 +
** InChIKey=YCCILVSKPBXVIP-UHFFFAOYSA-N
 
* molecular weight:
 
* molecular weight:
** 140.164    
+
** 138.166    
 
* Synonym(s):
 
* Synonym(s):
** L-histidinal
+
** p-hydroxyphenylethanol
 +
** 2-(4-hydroxyphenyl)ethanol
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[HISTALDEHYD-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN3O-4113]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[HISTOLDEHYD-RXN]]
 
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=57339283 57339283]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=10393 10393]
* CHEBI:
+
* HMDB : HMDB04284
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=64802 64802]
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C01929 C01929]
+
** [http://www.genome.jp/dbget-bin/www_bget?C06044 C06044]
* HMDB : HMDB12234
+
* CHEMSPIDER:
{{#set: smiles=C1(NC=NC=1CC([CH]=O)[N+])}}
+
** [http://www.chemspider.com/Chemical-Structure.9964.html 9964]
{{#set: inchi key=InChIKey=VYOIELONWKIZJS-YFKPBYRVSA-O}}
+
* CHEBI:
{{#set: common name=histidinal}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=1879 1879]
{{#set: molecular weight=140.164   }}
+
* METABOLIGHTS : MTBLC1879
{{#set: common name=L-histidinal}}
+
{{#set: smiles=C1(C(=CC=C(C=1)O)CCO)}}
{{#set: consumed by=HISTALDEHYD-RXN}}
+
{{#set: common name=4-tyrosol}}
{{#set: reversible reaction associated=HISTOLDEHYD-RXN}}
+
{{#set: inchi key=InChIKey=YCCILVSKPBXVIP-UHFFFAOYSA-N}}
 +
{{#set: molecular weight=138.166   }}
 +
{{#set: common name=p-hydroxyphenylethanol|2-(4-hydroxyphenyl)ethanol}}
 +
{{#set: produced by=RXN3O-4113}}

Revision as of 16:01, 21 March 2018

Metabolite CPD3O-4151

  • smiles:
    • C1(C(=CC=C(C=1)O)CCO)
  • common name:
    • 4-tyrosol
  • inchi key:
    • InChIKey=YCCILVSKPBXVIP-UHFFFAOYSA-N
  • molecular weight:
    • 138.166
  • Synonym(s):
    • p-hydroxyphenylethanol
    • 2-(4-hydroxyphenyl)ethanol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • HMDB : HMDB04284
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC1879