Difference between revisions of "CPD-15163"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10284 CPD-10284] == * smiles: ** CCCCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15163 CPD-15163] == * smiles: ** C#CC=O * inchi key: ** InChIKey=IJNJLGFTSIAHEA-UHFFFAOYSA-...")
 
(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-10284 CPD-10284] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15163 CPD-15163] ==
 
* smiles:
 
* smiles:
−
** CCCCCCCCCCCC(=O)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-]
+
** C#CC=O
 
* inchi key:
 
* inchi key:
−
** InChIKey=IQNFBGHLIVBNOU-QSGBVPJFSA-J
+
** InChIKey=IJNJLGFTSIAHEA-UHFFFAOYSA-N
 
* common name:
 
* common name:
−
** 3-oxo-myristoyl-CoA
+
** prop-2-ynal
 
* molecular weight:
 
* molecular weight:
−
** 987.845    
+
** 54.048    
 
* Synonym(s):
 
* Synonym(s):
−
** 3-oxotetradecanoyl-CoA
+
** propiolaldehyde
 +
** 2-propynal
 +
** propynal
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-14268]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-12507]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-14224]]
 
== External links  ==
 
== External links  ==
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C05261 C05261]
+
** [http://www.genome.jp/dbget-bin/www_bget?C05985 C05985]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62543 62543]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27976 27976]
−
* BIGG : 45449
+
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245316 25245316]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=12222 12222]
−
* HMDB : HMDB03935
+
* HMDB : HMDB06803
−
{{#set: smiles=CCCCCCCCCCCC(=O)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-]}}
+
{{#set: smiles=C#CC=O}}
−
{{#set: inchi key=InChIKey=IQNFBGHLIVBNOU-QSGBVPJFSA-J}}
+
{{#set: inchi key=InChIKey=IJNJLGFTSIAHEA-UHFFFAOYSA-N}}
−
{{#set: common name=3-oxo-myristoyl-CoA}}
+
{{#set: common name=prop-2-ynal}}
−
{{#set: molecular weight=987.845   }}
+
{{#set: molecular weight=54.048   }}
−
{{#set: common name=3-oxotetradecanoyl-CoA}}
+
{{#set: common name=propiolaldehyde|2-propynal|propynal}}
−
{{#set: consumed by=RXN-14268}}
+
{{#set: reversible reaction associated=RXN-14224}}
−
{{#set: produced by=RXN-12507}}
+

Latest revision as of 19:23, 21 March 2018

Metabolite CPD-15163

  • smiles:
    • C#CC=O
  • inchi key:
    • InChIKey=IJNJLGFTSIAHEA-UHFFFAOYSA-N
  • common name:
    • prop-2-ynal
  • molecular weight:
    • 54.048
  • Synonym(s):
    • propiolaldehyde
    • 2-propynal
    • propynal

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




Retrieved from "http://gem-aureme.irisa.fr/ectogem/index.php?title=CPD-15163&oldid=26584"