Difference between revisions of "BENZOYLCOA"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=OCTAPRENYL-DIPHOSPHATE OCTAPRENYL-DIPHOSPHATE] == * smiles: ** CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC...")
 
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=OCTAPRENYL-DIPHOSPHATE OCTAPRENYL-DIPHOSPHATE] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BENZOYLCOA BENZOYLCOA] ==
 
* smiles:
 
* smiles:
−
** CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]
+
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)C1(=CC=CC=C1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]
 +
* molecular weight:
 +
** 867.61   
 
* inchi key:
 
* inchi key:
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** InChIKey=IKKLDISSULFFQO-DJMILUHSSA-K
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** InChIKey=VEVJTUNLALKRNO-TYHXJLICSA-J
 
* common name:
 
* common name:
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** all-trans-octaprenyl diphosphate
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** benzoyl-CoA
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* molecular weight:
+
−
** 719.897   
+
 
* Synonym(s):
 
* Synonym(s):
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** farnesylfarnesylgeranyl-PP
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** S-benzoate coenzyme A
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** octaprenyl pyrophosphate
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** benzoyl-S-CoA
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** OPP
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−
** farnesylfarnesylgeraniol
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−
** octaprenyl diphosphate
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
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* [[4OHBENZOATE-OCTAPRENYLTRANSFER-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-2006]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* LIGAND-CPD:
 
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** [http://www.genome.jp/dbget-bin/www_bget?C04146 C04146]
 
 
* CHEBI:
 
* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57711 57711]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57369 57369]
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* BIGG : octdp
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* CAS : 102185-37-5
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245331 25245331]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266596 45266596]
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* HMDB : HMDB01094
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* LIGAND-CPD:
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{{#set: smiles=CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00512 C00512]
−
{{#set: inchi key=InChIKey=IKKLDISSULFFQO-DJMILUHSSA-K}}
+
* HMDB : HMDB02252
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{{#set: common name=all-trans-octaprenyl diphosphate}}
+
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)C1(=CC=CC=C1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]}}
−
{{#set: molecular weight=719.897    }}
+
{{#set: molecular weight=867.61    }}
−
{{#set: common name=farnesylfarnesylgeranyl-PP|octaprenyl pyrophosphate|OPP|farnesylfarnesylgeraniol|octaprenyl diphosphate}}
+
{{#set: inchi key=InChIKey=VEVJTUNLALKRNO-TYHXJLICSA-J}}
−
{{#set: consumed by=4OHBENZOATE-OCTAPRENYLTRANSFER-RXN}}
+
{{#set: common name=benzoyl-CoA}}
 +
{{#set: common name=S-benzoate coenzyme A|benzoyl-S-CoA}}
 +
{{#set: produced by=RXN-2006}}

Latest revision as of 17:30, 9 January 2019

Metabolite BENZOYLCOA

  • smiles:
    • CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)C1(=CC=CC=C1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]
  • molecular weight:
    • 867.61
  • inchi key:
    • InChIKey=VEVJTUNLALKRNO-TYHXJLICSA-J
  • common name:
    • benzoyl-CoA
  • Synonym(s):
    • S-benzoate coenzyme A
    • benzoyl-S-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)C1(=CC=CC=C1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-" cannot be used as a page name in this wiki.



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