Difference between revisions of "CHC T00010085001"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17641 CPD-17641] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCCCCCCCO)COP(=O)...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DOPAQUINONE DOPAQUINONE] == * smiles: ** C([O-])(=O)C([N+])CC1(=CC(=O)C(=O)C=C1) * inchi key: *...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17641 CPD-17641] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DOPAQUINONE DOPAQUINONE] ==
 
* smiles:
 
* smiles:
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCCCCCCCO)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([O-])(=O)C([N+])CC1(=CC(=O)C(=O)C=C1)
 
* inchi key:
 
* inchi key:
** InChIKey=WMNWNRKMANJLHY-LFZQUHGESA-J
+
** InChIKey=AHMIDUVKSGCHAU-LURJTMIESA-N
 
* common name:
 
* common name:
** 18-hydroxystearoyl-CoA
+
** dopaquinone
 
* molecular weight:
 
* molecular weight:
** 1045.968    
+
** 195.174    
 
* Synonym(s):
 
* Synonym(s):
** ω-hydroxy-octadecanoyl-coenzyme A
 
** ω-hydroxystearoyl-CoA
 
** 18-hydroxy-octadecanoyl-CoA
 
  
 
== 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 ==
* [[RXN-16401]]
+
* [[RXN-13061]]
 +
* [[MONOPHENOL-MONOOXYGENASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C00822 C00822]
 +
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57924 57924]
 +
* METABOLIGHTS : MTBLC57924
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91819832 91819832]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44229226 44229226]
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCCCCCCCO)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 : HMDB01229
{{#set: inchi key=InChIKey=WMNWNRKMANJLHY-LFZQUHGESA-J}}
+
{{#set: smiles=C([O-])(=O)C([N+])CC1(=CC(=O)C(=O)C=C1)}}
{{#set: common name=18-hydroxystearoyl-CoA}}
+
{{#set: inchi key=InChIKey=AHMIDUVKSGCHAU-LURJTMIESA-N}}
{{#set: molecular weight=1045.968   }}
+
{{#set: common name=dopaquinone}}
{{#set: common name=ω-hydroxy-octadecanoyl-coenzyme A|ω-hydroxystearoyl-CoA|18-hydroxy-octadecanoyl-CoA}}
+
{{#set: molecular weight=195.174   }}
{{#set: produced by=RXN-16401}}
+
{{#set: produced by=RXN-13061|MONOPHENOL-MONOOXYGENASE-RXN}}

Revision as of 12:04, 18 January 2018

Metabolite DOPAQUINONE

  • smiles:
    • C([O-])(=O)C([N+])CC1(=CC(=O)C(=O)C=C1)
  • inchi key:
    • InChIKey=AHMIDUVKSGCHAU-LURJTMIESA-N
  • common name:
    • dopaquinone
  • molecular weight:
    • 195.174
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC57924
  • PUBCHEM:
  • HMDB : HMDB01229
"C([O-])(=O)C([N+])CC1(=CC(=O)C(=O)C=C1)" cannot be used as a page name in this wiki.