Difference between revisions of "CPD-15691"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8343 CPD-8343] == * smiles: ** CCCCCCCCCCCCCCCC(OCC(O)COP([O-])(=O)OCC[N+](C)(C)C)=O * inch...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15691 CPD-15691] == * smiles: ** CCCCCCC=CCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O...")
 
(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-8343 CPD-8343] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15691 CPD-15691] ==
 
* smiles:
 
* smiles:
−
** CCCCCCCCCCCCCCCC(OCC(O)COP([O-])(=O)OCC[N+](C)(C)C)=O
+
** CCCCCCC=CCC(=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-]
−
* inchi key:
+
−
** InChIKey=ASWBNKHCZGQVJV-HSZRJFAPSA-N
+
 
* common name:
 
* common name:
−
** 1-16:0-2-lysophosphatidylcholine
+
** 5-trans-3-oxo-dodecenoyl-CoA
 +
* inchi key:
 +
** InChIKey=VKLHSLOWDWGVGP-WOABMHMMSA-J
 
* molecular weight:
 
* molecular weight:
−
** 495.635    
+
** 957.775    
 
* Synonym(s):
 
* Synonym(s):
−
** 1-16:0-lysoPC
+
** 5E-3-oxo-dodecenoyl-CoA
−
** 1-hexadecanoyl-sn-glycero-3-phosphocholine
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-14803]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-15065]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[RXN-15066]]
 
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=460602 460602]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658857 90658857]
−
* HMDB : HMDB10382
+
{{#set: smiles=CCCCCCC=CCC(=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-]}}
−
* LIGAND-CPD:
+
{{#set: common name=5-trans-3-oxo-dodecenoyl-CoA}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C04102 C04102]
+
{{#set: inchi key=InChIKey=VKLHSLOWDWGVGP-WOABMHMMSA-J}}
−
* CHEMSPIDER:
+
{{#set: molecular weight=957.775   }}
−
** [http://www.chemspider.com/Chemical-Structure.78064.html 78064]
+
{{#set: common name=5E-3-oxo-dodecenoyl-CoA}}
−
* CHEBI:
+
{{#set: consumed by=RXN-14803}}
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=72998 72998]
+
−
* METABOLIGHTS : MTBLC72998
+
−
{{#set: smiles=CCCCCCCCCCCCCCCC(OCC(O)COP([O-])(=O)OCC[N+](C)(C)C)=O}}
+
−
{{#set: inchi key=InChIKey=ASWBNKHCZGQVJV-HSZRJFAPSA-N}}
+
−
{{#set: common name=1-16:0-2-lysophosphatidylcholine}}
+
−
{{#set: molecular weight=495.635   }}
+
−
{{#set: common name=1-16:0-lysoPC|1-hexadecanoyl-sn-glycero-3-phosphocholine}}
+
−
{{#set: produced by=RXN-15065}}
+
−
{{#set: consumed or produced by=RXN-15066}}
+

Latest revision as of 20:05, 21 March 2018

Metabolite CPD-15691

  • smiles:
    • CCCCCCC=CCC(=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-]
  • common name:
    • 5-trans-3-oxo-dodecenoyl-CoA
  • inchi key:
    • InChIKey=VKLHSLOWDWGVGP-WOABMHMMSA-J
  • molecular weight:
    • 957.775
  • Synonym(s):
    • 5E-3-oxo-dodecenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCC=CCC(=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-" cannot be used as a page name in this wiki.



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