Difference between revisions of "3-OXOADIPATE-ENOL-LACTONE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17373 CPD-17373] == * smiles: ** C(O)CCCCCCCC=CCCCCCCCC(OCC(OC(=O)CCCCCCCC=CCC=CCCCCCO)COP(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-OXOADIPATE-ENOL-LACTONE 3-OXOADIPATE-ENOL-LACTONE] == * smiles: ** C(=O)(CC1(=CCC(=O)O1))[O-]...")
 
(2 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17373 CPD-17373] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-OXOADIPATE-ENOL-LACTONE 3-OXOADIPATE-ENOL-LACTONE] ==
 
* smiles:
 
* smiles:
** C(O)CCCCCCCC=CCCCCCCCC(OCC(OC(=O)CCCCCCCC=CCC=CCCCCCO)COP([O-])(=O)[O-])=O
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** C(=O)(CC1(=CCC(=O)O1))[O-]
* inchi key:
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** InChIKey=ZXBGEIHFXPHRJY-NKFDZXFUSA-L
+
 
* common name:
 
* common name:
** 1-[18-hydroxyoeoyl]-2-[18-hydroxy-lioleoyl]-sn-glycerol 3-phosphate
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** (4,5-dihydro-5-oxofuran-2-yl)-acetate
 +
* inchi key:
 +
** InChIKey=ZPEHSARSWGDCEX-UHFFFAOYSA-M
 
* molecular weight:
 
* molecular weight:
** 728.942    
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** 141.103    
 
* Synonym(s):
 
* Synonym(s):
 +
** 3-oxoadipate enol lactone
 +
** β-ketoadipate-enol-lactone
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-16121]]
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* [[3-OXOADIPATE-ENOL-LACTONASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-16118]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91819824 91819824]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=23615198 23615198]
{{#set: smiles=C(O)CCCCCCCC=CCCCCCCCC(OCC(OC(=O)CCCCCCCC=CCC=CCCCCCO)COP([O-])(=O)[O-])=O}}
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* CHEMSPIDER:
{{#set: inchi key=InChIKey=ZXBGEIHFXPHRJY-NKFDZXFUSA-L}}
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** [http://www.chemspider.com/Chemical-Structure.19951100.html 19951100]
{{#set: common name=1-[18-hydroxyoeoyl]-2-[18-hydroxy-lioleoyl]-sn-glycerol 3-phosphate}}
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* CHEBI:
{{#set: molecular weight=728.942   }}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58425 58425]
{{#set: consumed by=RXN-16121}}
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* LIGAND-CPD:
{{#set: produced by=RXN-16118}}
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** [http://www.genome.jp/dbget-bin/www_bget?C03586 C03586]
 +
{{#set: smiles=C(=O)(CC1(=CCC(=O)O1))[O-]}}
 +
{{#set: common name=(4,5-dihydro-5-oxofuran-2-yl)-acetate}}
 +
{{#set: inchi key=InChIKey=ZPEHSARSWGDCEX-UHFFFAOYSA-M}}
 +
{{#set: molecular weight=141.103   }}
 +
{{#set: common name=3-oxoadipate enol lactone|β-ketoadipate-enol-lactone}}
 +
{{#set: consumed by=3-OXOADIPATE-ENOL-LACTONASE-RXN}}

Latest revision as of 20:19, 21 March 2018

Metabolite 3-OXOADIPATE-ENOL-LACTONE

  • smiles:
    • C(=O)(CC1(=CCC(=O)O1))[O-]
  • common name:
    • (4,5-dihydro-5-oxofuran-2-yl)-acetate
  • inchi key:
    • InChIKey=ZPEHSARSWGDCEX-UHFFFAOYSA-M
  • molecular weight:
    • 141.103
  • Synonym(s):
    • 3-oxoadipate enol lactone
    • β-ketoadipate-enol-lactone

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C(=O)(CC1(=CCC(=O)O1))[O-" cannot be used as a page name in this wiki.