Difference between revisions of "S-1-PHENYLETHANOL"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=MEVALONATE MEVALONATE] == * smiles: ** CC(O)(CCO)CC(=O)[O-] * inchi key: ** InChIKey=KJTLQQUUPV...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=S-1-PHENYLETHANOL S-1-PHENYLETHANOL] == * smiles: ** CC(O)C1(C=CC=CC=1) * inchi key: ** InChIKe...")
 
(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=MEVALONATE MEVALONATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=S-1-PHENYLETHANOL S-1-PHENYLETHANOL] ==
 
* smiles:
 
* smiles:
** CC(O)(CCO)CC(=O)[O-]
+
** CC(O)C1(C=CC=CC=1)
 
* inchi key:
 
* inchi key:
** InChIKey=KJTLQQUUPVSXIM-ZCFIWIBFSA-M
+
** InChIKey=WAPNOHKVXSQRPX-ZETCQYMHSA-N
 
* common name:
 
* common name:
** (R)-mevalonate
+
** (S)-1-phenylethanol
 
* molecular weight:
 
* molecular weight:
** 147.15    
+
** 122.166    
 
* Synonym(s):
 
* Synonym(s):
** mevalonate
 
** mevalonic acid
 
  
 
== 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 ==
* [[MEVALONATE-KINASE-RXN]]
+
* [[RXN-1302]]
* [[1.1.1.34-RXN]]
+
 
== External links  ==
 
== External links  ==
* DRUGBANK : DB03518
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5288798 5288798]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=443135 443135]
* HMDB : HMDB59629
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C00418 C00418]
+
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.4450890.html 4450890]
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** [http://www.chemspider.com/Chemical-Structure.391409.html 391409]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=36464 36464]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16346 16346]
* METABOLIGHTS : MTBLC36464
+
* LIGAND-CPD:
{{#set: smiles=CC(O)(CCO)CC(=O)[O-]}}
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** [http://www.genome.jp/dbget-bin/www_bget?C11348 C11348]
{{#set: inchi key=InChIKey=KJTLQQUUPVSXIM-ZCFIWIBFSA-M}}
+
{{#set: smiles=CC(O)C1(C=CC=CC=1)}}
{{#set: common name=(R)-mevalonate}}
+
{{#set: inchi key=InChIKey=WAPNOHKVXSQRPX-ZETCQYMHSA-N}}
{{#set: molecular weight=147.15   }}
+
{{#set: common name=(S)-1-phenylethanol}}
{{#set: common name=mevalonate|mevalonic acid}}
+
{{#set: molecular weight=122.166   }}
{{#set: reversible reaction associated=MEVALONATE-KINASE-RXN|1.1.1.34-RXN}}
+
{{#set: reversible reaction associated=RXN-1302}}

Latest revision as of 19:53, 21 March 2018

Metabolite S-1-PHENYLETHANOL

  • smiles:
    • CC(O)C1(C=CC=CC=1)
  • inchi key:
    • InChIKey=WAPNOHKVXSQRPX-ZETCQYMHSA-N
  • common name:
    • (S)-1-phenylethanol
  • molecular weight:
    • 122.166
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links