Difference between revisions of "CPD-6442"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-16097 RXN-16097] == * direction: ** LEFT-TO-RIGHT * ec number: ** [http://enzyme.expasy.org/EC/...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-1353 CPD1G-1353] == * smiles: ** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(...")
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-16097 RXN-16097] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-1353 CPD1G-1353] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCCCC3(CC(CCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCCCC)C)3)
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* ec number:
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* inchi key:
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** [http://enzyme.expasy.org/EC/1.3.1.93 EC-1.3.1.93]
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** InChIKey=WPVQFTORCFMMCP-WBSUMZSHSA-N
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* common name:
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** trehalose-cis-keto-mono-mycolate
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* molecular weight:
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** 1590.555   
 
* Synonym(s):
 
* Synonym(s):
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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== Reaction(s) known to produce the compound ==
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** 1 [[PROTON]][c] '''+''' 1 [[CPD-17348]][c] '''+''' 1 [[NADPH]][c] '''=>''' 1 [[CPD-12646]][c] '''+''' 1 [[NADP]][c]
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* [[RXN1G-1438]]
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 H+[c] '''+''' 1 (2E, 11Z,14Z)-icosa-2,11,14-trienoyl-CoA[c] '''+''' 1 NADPH[c] '''=>''' 1 (11Z,14Z)-icosa-11,14-dienoyl-CoA[c] '''+''' 1 NADP+[c]
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== Genes associated with this reaction  ==
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== Pathways  ==
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* [[PWY-7601]], arachidonate biosynthesis IV (8-detaturase, lower eukaryotes): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7601 PWY-7601]
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** '''4''' reactions found over '''7''' reactions in the full pathway
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* [[PWY-7725]], arachidonate biosynthesis V (8-detaturase, mammals): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7725 PWY-7725]
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** '''5''' reactions found over '''6''' reactions in the full pathway
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* [[PWY-6598]], sciadonate biosynthesis: [http://metacyc.org/META/NEW-IMAGE?object=PWY-6598 PWY-6598]
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** '''4''' reactions found over '''5''' reactions in the full pathway
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== Reconstruction information  ==
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* Category: [[gap-filling]]
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** Source: [[gap-filling-gapfilling_solution_with_meneco_draft_medium]]
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*** Tool: [[meneco]]
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**** Comment: [[added for gapfilling]]
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== External links  ==
 
== External links  ==
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{{#set: direction=LEFT-TO-RIGHT}}
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* PUBCHEM:
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{{#set: ec number=EC-1.3.1.93}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657448 90657448]
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{{#set: in pathway=PWY-7601|PWY-7725|PWY-6598}}
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{{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCCCC3(CC(CCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCCCC)C)3)}}
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{{#set: reconstruction category=gap-filling}}
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{{#set: inchi key=InChIKey=WPVQFTORCFMMCP-WBSUMZSHSA-N}}
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{{#set: reconstruction source=gap-filling-gapfilling_solution_with_meneco_draft_medium}}
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{{#set: common name=trehalose-cis-keto-mono-mycolate}}
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{{#set: reconstruction tool=meneco}}
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{{#set: molecular weight=1590.555    }}
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{{#set: reconstruction comment=added for gapfilling}}
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{{#set: produced by=RXN1G-1438}}

Revision as of 13:53, 21 March 2018

Metabolite CPD1G-1353

  • smiles:
    • CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)CO)O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCCCC3(CC(CCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCCCC)C)3)
  • inchi key:
    • InChIKey=WPVQFTORCFMMCP-WBSUMZSHSA-N
  • common name:
    • trehalose-cis-keto-mono-mycolate
  • molecular weight:
    • 1590.555
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links



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