Difference between revisions of "CPD-14422"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-13733 RXN-13733] == * direction: ** REVERSIBLE * common name: ** alkaline_dihydroceramidase * e...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14422 CPD-14422] == * smiles: ** CCC=CCC=CCC=CCCCCCCCC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C...")
 
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[[Category:Reaction]]
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[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-13733 RXN-13733] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14422 CPD-14422] ==
* direction:
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* smiles:
** REVERSIBLE
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** CCC=CCC=CCC=CCCCCCCCC(=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-]
 
* common name:
 
* common name:
** alkaline_dihydroceramidase
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** 3-oxo-icosatrienoyl-CoA
* ec number:
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* inchi key:
** [http://enzyme.expasy.org/EC/3.5.1.23 EC-3.5.1.23]
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** InChIKey=DFYFQQXXTCLFNG-UBQHHBPXSA-J
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* molecular weight:
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** 1065.958   
 
* Synonym(s):
 
* Synonym(s):
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** (9Z,12Z,15Z)-octadecatrienoyl-CoA
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** 3-oxo-eicosatrienoyl-CoA
  
== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
* With identifiers:
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* [[RXN-12994]]
** 1 [[CPD3DJ-82]][c] '''+''' 1 [[WATER]][c] '''<=>''' 1 [[CPD-13612]][c] '''+''' 1 [[Carboxylates]][c]
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== Reaction(s) known to produce the compound ==
* With common name(s):
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* [[RXN-13441]]
** 1 a dihydroceramide[c] '''+''' 1 H2O[c] '''<=>''' 1 D-erythro-sphinganine[c] '''+''' 1 a carboxylate[c]
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== Reaction(s) of unknown directionality ==
 
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== Genes associated with this reaction  ==
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Genes have been associated with this reaction based on different elements listed below.
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* [[Tiso_gene_14341]]
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** [[pantograph]]-[[esiliculosus]]
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* [[Tiso_gene_4555]]
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** IN-SILICO_ANNOTATION
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***AUTOMATED-NAME-MATCH
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== Pathways  ==
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* [[PWY-7119]], sphingolipid recycling and degradation (yeast): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7119 PWY-7119]
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** '''5''' reactions found over '''11''' reactions in the full pathway
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== Reconstruction information  ==
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* [[orthology]]:
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** [[pantograph]]:
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*** [[esiliculosus]]
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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[in-silico_annotation]]
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== External links  ==
 
== External links  ==
{{#set: direction=REVERSIBLE}}
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* PUBCHEM:
{{#set: common name=alkaline_dihydroceramidase}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=71581047 71581047]
{{#set: ec number=EC-3.5.1.23}}
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* CHEBI:
{{#set: gene associated=Tiso_gene_14341|Tiso_gene_4555}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=74054 74054]
{{#set: in pathway=PWY-7119}}
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{{#set: smiles=CCC=CCC=CCC=CCCCCCCCC(=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-]}}
{{#set: reconstruction category=orthology}}
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{{#set: common name=3-oxo-icosatrienoyl-CoA}}
{{#set: reconstruction tool=pantograph}}
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{{#set: inchi key=InChIKey=DFYFQQXXTCLFNG-UBQHHBPXSA-J}}
{{#set: reconstruction source=esiliculosus}}
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{{#set: molecular weight=1065.958    }}
{{#set: reconstruction category=annotation}}
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{{#set: common name=(9Z,12Z,15Z)-octadecatrienoyl-CoA|3-oxo-eicosatrienoyl-CoA}}
{{#set: reconstruction tool=pathwaytools}}
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{{#set: consumed by=RXN-12994}}
{{#set: reconstruction source=in-silico_annotation}}
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{{#set: produced by=RXN-13441}}

Latest revision as of 20:21, 21 March 2018

Metabolite CPD-14422

  • smiles:
    • CCC=CCC=CCC=CCCCCCCCC(=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-]
  • common name:
    • 3-oxo-icosatrienoyl-CoA
  • inchi key:
    • InChIKey=DFYFQQXXTCLFNG-UBQHHBPXSA-J
  • molecular weight:
    • 1065.958
  • Synonym(s):
    • (9Z,12Z,15Z)-octadecatrienoyl-CoA
    • 3-oxo-eicosatrienoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCC=CCC=CCC=CCCCCCCCC(=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.