Difference between revisions of "ETOH"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15661 CPD-15661] == * smiles: ** CCCCCCC=CC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ETOH ETOH] == * smiles: ** CCO * inchi key: ** InChIKey=LFQSCWFLJHTTHZ-UHFFFAOYSA-N * common na...")
 
(2 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15661 CPD-15661] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ETOH ETOH] ==
 
* smiles:
 
* smiles:
** CCCCCCC=CC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
+
** CCO
 
* inchi key:
 
* inchi key:
** InChIKey=SZKPLUULGGERFD-MSNZEOPQSA-J
+
** InChIKey=LFQSCWFLJHTTHZ-UHFFFAOYSA-N
 
* common name:
 
* common name:
** 2-trans, 4-trans-undecadienoyl-CoA
+
** ethanol
 
* molecular weight:
 
* molecular weight:
** 927.749    
+
** 46.069    
 
* Synonym(s):
 
* Synonym(s):
** 2E, 4E-undecadienoyl-CoA
+
** absolute alcohol
 +
** alcohol
 +
** EtOH
 +
** eth
 +
** ethyl alcohol
 +
** grain alcohol
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-14790]]
+
* [[RXN66-1]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14789]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 64-17-5
 +
* BIGG : 35062
 +
* DRUGBANK : DB00898
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658303 90658303]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=702 702]
{{#set: smiles=CCCCCCC=CC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]}}
+
* HMDB : HMDB00108
{{#set: inchi key=InChIKey=SZKPLUULGGERFD-MSNZEOPQSA-J}}
+
* LIGAND-CPD:
{{#set: common name=2-trans, 4-trans-undecadienoyl-CoA}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C00469 C00469]
{{#set: molecular weight=927.749   }}
+
* CHEMSPIDER:
{{#set: common name=2E, 4E-undecadienoyl-CoA}}
+
** [http://www.chemspider.com/Chemical-Structure.682.html 682]
{{#set: consumed by=RXN-14790}}
+
* CHEBI:
{{#set: produced by=RXN-14789}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16236 16236]
 +
* METABOLIGHTS : MTBLC16236
 +
{{#set: smiles=CCO}}
 +
{{#set: inchi key=InChIKey=LFQSCWFLJHTTHZ-UHFFFAOYSA-N}}
 +
{{#set: common name=ethanol}}
 +
{{#set: molecular weight=46.069   }}
 +
{{#set: common name=absolute alcohol|alcohol|EtOH|eth|ethyl alcohol|grain alcohol}}
 +
{{#set: consumed by=RXN66-1}}

Latest revision as of 19:41, 21 March 2018

Metabolite ETOH

  • smiles:
    • CCO
  • inchi key:
    • InChIKey=LFQSCWFLJHTTHZ-UHFFFAOYSA-N
  • common name:
    • ethanol
  • molecular weight:
    • 46.069
  • Synonym(s):
    • absolute alcohol
    • alcohol
    • EtOH
    • eth
    • ethyl alcohol
    • grain alcohol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 64-17-5
  • BIGG : 35062
  • DRUGBANK : DB00898
  • PUBCHEM:
  • HMDB : HMDB00108
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16236