Difference between revisions of "CPD-18352"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=GLUTARYL-COA GLUTARYL-COA] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CCCC(=O)[O-])=O)COP(=O)...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18352 CPD-18352] == * smiles: ** CCCCCCC=CCCCCCCCCCC(OC(COC(=O)CCCCCCCCCCCCCCC)COP([O-])(=O...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=GLUTARYL-COA GLUTARYL-COA] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18352 CPD-18352] ==
 
* smiles:
 
* smiles:
−
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CCCC(=O)[O-])=O)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-]
+
** CCCCCCC=CCCCCCCCCCC(OC(COC(=O)CCCCCCCCCCCCCCC)COP([O-])(=O)[O-])=O
 
* inchi key:
 
* inchi key:
−
** InChIKey=SYKWLIJQEHRDNH-CKRMAKSASA-I
+
** InChIKey=YDFKTEAAIYLUQP-WNHJEKBPSA-L
 
* common name:
 
* common name:
−
** glutaryl-CoA
+
** 1-palmitoyl-2-cis-vaccenoyl phosphatidate
 
* molecular weight:
 
* molecular weight:
−
** 876.595    
+
** 672.921    
 
* Synonym(s):
 
* Synonym(s):
−
** glutaryl-coenzyme A
+
** 16:0-18:1-PA
−
** 4-carboxybutanoyl-CoA
+
** 1-palmitoyl-2-(11Z-octadecenoyl)-sn-glycerol-3-phosphate
  
 
== 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 ==
−
* [[2-KETO-ADIPATE-DEHYDROG-RXN]]
+
* [[RXN-17010]]
 +
* [[RXN-17014]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[RXN-8032]]
 
 
== External links  ==
 
== External links  ==
−
* LIGAND-CPD:
+
{{#set: smiles=CCCCCCC=CCCCCCCCCCC(OC(COC(=O)CCCCCCCCCCCCCCC)COP([O-])(=O)[O-])=O}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C00527 C00527]
+
{{#set: inchi key=InChIKey=YDFKTEAAIYLUQP-WNHJEKBPSA-L}}
−
* CHEBI:
+
{{#set: common name=1-palmitoyl-2-cis-vaccenoyl phosphatidate}}
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57378 57378]
+
{{#set: molecular weight=672.921   }}
−
* METABOLIGHTS : MTBLC57378
+
{{#set: common name=16:0-18:1-PA|1-palmitoyl-2-(11Z-octadecenoyl)-sn-glycerol-3-phosphate}}
−
* PUBCHEM:
+
{{#set: produced by=RXN-17010|RXN-17014}}
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266604 45266604]
+
−
* HMDB : HMDB01339
+
−
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CCCC(=O)[O-])=O)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: inchi key=InChIKey=SYKWLIJQEHRDNH-CKRMAKSASA-I}}
+
−
{{#set: common name=glutaryl-CoA}}
+
−
{{#set: molecular weight=876.595   }}
+
−
{{#set: common name=glutaryl-coenzyme A|4-carboxybutanoyl-CoA}}
+
−
{{#set: produced by=2-KETO-ADIPATE-DEHYDROG-RXN}}
+
−
{{#set: reversible reaction associated=RXN-8032}}
+

Latest revision as of 20:09, 21 March 2018

Metabolite CPD-18352

  • smiles:
    • CCCCCCC=CCCCCCCCCCC(OC(COC(=O)CCCCCCCCCCCCCCC)COP([O-])(=O)[O-])=O
  • inchi key:
    • InChIKey=YDFKTEAAIYLUQP-WNHJEKBPSA-L
  • common name:
    • 1-palmitoyl-2-cis-vaccenoyl phosphatidate
  • molecular weight:
    • 672.921
  • Synonym(s):
    • 16:0-18:1-PA
    • 1-palmitoyl-2-(11Z-octadecenoyl)-sn-glycerol-3-phosphate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCC=CCCCCCCCCCC(OC(COC(=O)CCCCCCCCCCCCCCC)COP([O-])(=O)[O-])=O" cannot be used as a page name in this wiki.



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