Difference between revisions of "CPD-101"

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(Created page with "Category:Pathway == Pathway [http://metacyc.org/META/NEW-IMAGE?object=PWY-7445 PWY-7445] == * taxonomic range: ** [http://metacyc.org/META/NEW-IMAGE?object=TAX-3398 TAX-33...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-101 CPD-101] == * smiles: ** C1(OCCCCC1)=O * common name: ** ε-caprolactone * inchi...")
 
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[[Category:Pathway]]
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[[Category:Metabolite]]
== Pathway [http://metacyc.org/META/NEW-IMAGE?object=PWY-7445 PWY-7445] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-101 CPD-101] ==
* taxonomic range:
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* smiles:
** [http://metacyc.org/META/NEW-IMAGE?object=TAX-3398 TAX-3398]
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** C1(OCCCCC1)=O
 
* common name:
 
* common name:
** luteolin triglucuronide degradation
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** ε-caprolactone
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* inchi key:
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** InChIKey=PAPBSGBWRJIAAV-UHFFFAOYSA-N
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* molecular weight:
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** 114.144   
 
* Synonym(s):
 
* Synonym(s):
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** 1-oxa-2-oxocycloheptane
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** 6-hexanolide
 +
** hexano-6-lactone
  
== Reaction(s) found ==
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== Reaction(s) known to consume the compound ==
'''3''' reactions found over '''4''' reactions in the full pathway
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== Reaction(s) known to produce the compound ==
* [[RXN-15288]]
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* [[CYCLOHEXANONE-MONOOXYGENASE-RXN]]
** 11 associated gene(s):
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== Reaction(s) of unknown directionality ==
*** [[Tiso_gene_11016]]
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*** [[Tiso_gene_15820]]
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*** [[Tiso_gene_16028]]
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*** [[Tiso_gene_5857]]
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*** [[Tiso_gene_6431]]
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*** [[Tiso_gene_20206]]
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*** [[Tiso_gene_19683]]
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*** [[Tiso_gene_15962]]
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*** [[Tiso_gene_17551]]
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*** [[Tiso_gene_7067]]
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*** [[Tiso_gene_9359]]
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** 2 reconstruction source(s) associated:
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*** [[annotation-in-silico_annotation]]
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*** [[orthology-esiliculosus]]
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* [[RXN-15289]]
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** 1 associated gene(s):
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*** [[Tiso_gene_13087]]
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** 1 reconstruction source(s) associated:
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*** [[annotation-in-silico_annotation]]
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* [[RXN-15291]]
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** 1 associated gene(s):
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*** [[Tiso_gene_13087]]
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** 1 reconstruction source(s) associated:
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*** [[annotation-in-silico_annotation]]
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== Reaction(s) not found ==
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* [http://metacyc.org/META/NEW-IMAGE?object=RXN-15290 RXN-15290]
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== External links  ==
 
== External links  ==
{{#set: taxonomic range=TAX-3398}}
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* CAS : 502-44-3
{{#set: common name=luteolin triglucuronide degradation}}
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* PUBCHEM:
{{#set: reaction found=3}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=10401 10401]
{{#set: total reaction=4}}
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* HMDB : HMDB60476
{{#set: completion rate=75.0}}
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C01880 C01880]
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* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.9972.html 9972]
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* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17915 17915]
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{{#set: smiles=C1(OCCCCC1)=O}}
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{{#set: common name=ε-caprolactone}}
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{{#set: inchi key=InChIKey=PAPBSGBWRJIAAV-UHFFFAOYSA-N}}
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{{#set: molecular weight=114.144    }}
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{{#set: common name=1-oxa-2-oxocycloheptane|6-hexanolide|hexano-6-lactone}}
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{{#set: produced by=CYCLOHEXANONE-MONOOXYGENASE-RXN}}

Latest revision as of 20:46, 21 March 2018

Metabolite CPD-101

  • smiles:
    • C1(OCCCCC1)=O
  • common name:
    • ε-caprolactone
  • inchi key:
    • InChIKey=PAPBSGBWRJIAAV-UHFFFAOYSA-N
  • molecular weight:
    • 114.144
  • Synonym(s):
    • 1-oxa-2-oxocycloheptane
    • 6-hexanolide
    • hexano-6-lactone

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links