Difference between revisions of "CPD-19155"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHOSPHO-ENOL-PYRUVATE PHOSPHO-ENOL-PYRUVATE] == * smiles: ** C=C(OP([O-])([O-])=O)C([O-])=O * i...")
 
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHOSPHO-ENOL-PYRUVATE PHOSPHO-ENOL-PYRUVATE] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19155 CPD-19155] ==
 
* smiles:
 
* smiles:
** C=C(OP([O-])([O-])=O)C([O-])=O
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** CCCCCCC=CCCCCCC(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-]
 +
* molecular weight:
 +
** 1015.898   
 
* inchi key:
 
* inchi key:
** InChIKey=DTBNBXWJWCWCIK-UHFFFAOYSA-K
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** InChIKey=ZIRSQPAPHGZDIL-VSCXGISKSA-J
 
* common name:
 
* common name:
** phosphoenolpyruvate
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** (S)-3-hydroxy-(9Z)-hexadecenoyl-CoA
* molecular weight:
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** 165.019   
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* Synonym(s):
 
* Synonym(s):
** PEP
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** (S)-3-hydroxy-16:1-Δ9-CoA
** 2-(phosphonooxy)- 2-propenoate
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** (S)-3-hydroxy-9-cis-hexadecenoyl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[PEPCARBOX-RXN]]
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* [[RXN-17790]]
* [[BIOMASS-RXN]]
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== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[PYRUVATEORTHOPHOSPHATE-DIKINASE-RXN]]
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* [[RXN-17789]]
* [[PEPSYNTH-RXN]]
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== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[RXN-14117]]
 
* [[DAHPSYN-RXN]]
 
* [[2.5.1.19-RXN]]
 
* [[RXN-14192]]
 
* [[PEPDEPHOS-RXN]]
 
* [[RXN-14207]]
 
* [[2PGADEHYDRAT-RXN]]
 
 
== External links  ==
 
== External links  ==
* CAS : 138-08-9
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{{#set: smiles=CCCCCCC=CCCCCCC(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-]}}
* PUBCHEM:
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{{#set: molecular weight=1015.898    }}
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3674425 3674425]
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{{#set: inchi key=InChIKey=ZIRSQPAPHGZDIL-VSCXGISKSA-J}}
* HMDB : HMDB00263
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{{#set: common name=(S)-3-hydroxy-(9Z)-hexadecenoyl-CoA}}
* LIGAND-CPD:
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{{#set: common name=(S)-3-hydroxy-16:1-Δ9-CoA|(S)-3-hydroxy-9-cis-hexadecenoyl-CoA}}
** [http://www.genome.jp/dbget-bin/www_bget?C00074 C00074]
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{{#set: consumed by=RXN-17790}}
* CHEMSPIDER:
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{{#set: produced by=RXN-17789}}
** [http://www.chemspider.com/Chemical-Structure.2907208.html 2907208]
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* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58702 58702]
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* BIGG : pep
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{{#set: smiles=C=C(OP([O-])([O-])=O)C([O-])=O}}
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{{#set: inchi key=InChIKey=DTBNBXWJWCWCIK-UHFFFAOYSA-K}}
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{{#set: common name=phosphoenolpyruvate}}
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{{#set: molecular weight=165.019    }}
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{{#set: common name=PEP|2-(phosphonooxy)- 2-propenoate}}
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{{#set: consumed by=PEPCARBOX-RXN|BIOMASS-RXN}}
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{{#set: produced by=PYRUVATEORTHOPHOSPHATE-DIKINASE-RXN|PEPSYNTH-RXN}}
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{{#set: consumed or produced by=RXN-14117|DAHPSYN-RXN|2.5.1.19-RXN|RXN-14192|PEPDEPHOS-RXN|RXN-14207|2PGADEHYDRAT-RXN}}
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Latest revision as of 17:53, 9 January 2019

Metabolite CPD-19155

  • smiles:
    • CCCCCCC=CCCCCCC(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-]
  • molecular weight:
    • 1015.898
  • inchi key:
    • InChIKey=ZIRSQPAPHGZDIL-VSCXGISKSA-J
  • common name:
    • (S)-3-hydroxy-(9Z)-hexadecenoyl-CoA
  • Synonym(s):
    • (S)-3-hydroxy-16:1-Δ9-CoA
    • (S)-3-hydroxy-9-cis-hexadecenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCC=CCCCCCC(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.