Difference between revisions of "PWY-7560"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17640 CPD-17640] == * smiles: ** C(O)CCCCCCCCCCCCCCCCC([O-])=O * inchi key: ** InChIKey=VLH...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-OXOPALMITOYL-COA 3-OXOPALMITOYL-COA] == * smiles: ** CCCCCCCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17640 CPD-17640] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-OXOPALMITOYL-COA 3-OXOPALMITOYL-COA] ==
 
* smiles:
 
* smiles:
** C(O)CCCCCCCCCCCCCCCCC([O-])=O
+
** CCCCCCCCCCCCCC(=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:
 
* inchi key:
** InChIKey=VLHZUYUOEGBBJB-UHFFFAOYSA-M
+
** InChIKey=NQMPLXPCRJOSHL-BBECNAHFSA-J
 
* common name:
 
* common name:
** 18-hydroxystearate
+
** 3-oxo-palmitoyl-CoA
 
* molecular weight:
 
* molecular weight:
** 299.473    
+
** 1015.898    
 
* Synonym(s):
 
* Synonym(s):
** 18-hydroxyoctadecanoate
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** 3-keto-palmitoyl-CoA
** 18-hydroxyoctadecanoic acid
+
** 3-oxohexadecanoyl-CoA
** 18-hydroxystearic acid
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-16401]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-14271]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* BIGG : 3ohdcoa
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=21891501 21891501]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25244191 25244191]
 +
* HMDB : HMDB06402
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C05259 C05259]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=86046 86046]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57349 57349]
{{#set: smiles=C(O)CCCCCCCCCCCCCCCCC([O-])=O}}
+
* METABOLIGHTS : MTBLC57349
{{#set: inchi key=InChIKey=VLHZUYUOEGBBJB-UHFFFAOYSA-M}}
+
{{#set: smiles=CCCCCCCCCCCCCC(=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: common name=18-hydroxystearate}}
+
{{#set: inchi key=InChIKey=NQMPLXPCRJOSHL-BBECNAHFSA-J}}
{{#set: molecular weight=299.473   }}
+
{{#set: common name=3-oxo-palmitoyl-CoA}}
{{#set: common name=18-hydroxyoctadecanoate|18-hydroxyoctadecanoic acid|18-hydroxystearic acid}}
+
{{#set: molecular weight=1015.898   }}
{{#set: consumed by=RXN-16401}}
+
{{#set: common name=3-keto-palmitoyl-CoA|3-oxohexadecanoyl-CoA}}
 +
{{#set: produced by=RXN-14271}}

Revision as of 10:48, 18 January 2018

Metabolite 3-OXOPALMITOYL-COA

  • smiles:
    • CCCCCCCCCCCCCC(=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=NQMPLXPCRJOSHL-BBECNAHFSA-J
  • common name:
    • 3-oxo-palmitoyl-CoA
  • molecular weight:
    • 1015.898
  • Synonym(s):
    • 3-keto-palmitoyl-CoA
    • 3-oxohexadecanoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • BIGG : 3ohdcoa
  • PUBCHEM:
  • HMDB : HMDB06402
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC57349
"CCCCCCCCCCCCCC(=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.