Difference between revisions of "Ec-01 001290"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=LINOLENIC_ACID LINOLENIC_ACID] == * smiles: ** CCC=CCC=CCC=CCCCCCCCC(=O)[O-] * inchi key: ** In...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=6Z8E10E14Z-5S12R-512-DIHYDROXYI 6Z8E10E14Z-5S12R-512-DIHYDROXYI] == * smiles: ** CCCCCC=CCC(O)C...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=LINOLENIC_ACID LINOLENIC_ACID] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=6Z8E10E14Z-5S12R-512-DIHYDROXYI 6Z8E10E14Z-5S12R-512-DIHYDROXYI] ==
 
* smiles:
 
* smiles:
−
** CCC=CCC=CCC=CCCCCCCCC(=O)[O-]
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** CCCCCC=CCC(O)C=CC=CC=CC(O)CCCC(=O)[O-]
 
* inchi key:
 
* inchi key:
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** InChIKey=DTOSIQBPPRVQHS-PDBXOOCHSA-M
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** InChIKey=VNYSSYRCGWBHLG-AMOLWHMGSA-M
 
* common name:
 
* common name:
−
** α-linolenate
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** leukotriene B4
 
* molecular weight:
 
* molecular weight:
−
** 277.426    
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** 335.462    
 
* Synonym(s):
 
* Synonym(s):
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** (9,12,15)-linolenic acid
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** (6z,8e,10e,14z)-(5s,12r)-5,12-dihydroxyicosa-6,8,10,14-tetraenoate
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** linolenate
+
−
** 9Z,12Z,15Z-octadecatrienoate
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−
** 9Z,12Z,15Z-octadecatrienoic acid
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−
** (9,12,15)-linolenate
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-1321]]
 
−
* [[LINOLENOYL-RXN]]
 
−
* [[RXN-8497]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-1501_METACYC18.5]]
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* [[LEUKOTRIENE-A4-HYDROLASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[R07861]]
 
 
== External links  ==
 
== External links  ==
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* CAS : 463-40-1
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* CAS : 71160-24-2
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* Wikipedia : Alpha-Linolenic_acid
+
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5461005 5461005]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=23615214 23615214]
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* HMDB : HMDB01388
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* HMDB : HMDB01085
 
* LIGAND-CPD:
 
* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C06427 C06427]
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** [http://www.genome.jp/dbget-bin/www_bget?C02165 C02165]
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* CHEMSPIDER:
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−
** [http://www.chemspider.com/Chemical-Structure.4574388.html 4574388]
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* CHEBI:
 
* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=32387 32387]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57461 57461]
−
* METABOLIGHTS : MTBLC32387
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* METABOLIGHTS : MTBLC57461
−
{{#set: smiles=CCC=CCC=CCC=CCCCCCCCC(=O)[O-]}}
+
{{#set: smiles=CCCCCC=CCC(O)C=CC=CC=CC(O)CCCC(=O)[O-]}}
−
{{#set: inchi key=InChIKey=DTOSIQBPPRVQHS-PDBXOOCHSA-M}}
+
{{#set: inchi key=InChIKey=VNYSSYRCGWBHLG-AMOLWHMGSA-M}}
−
{{#set: common name=α-linolenate}}
+
{{#set: common name=leukotriene B4}}
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{{#set: molecular weight=277.426   }}
+
{{#set: molecular weight=335.462   }}
−
{{#set: common name=(9,12,15)-linolenic acid|linolenate|9Z,12Z,15Z-octadecatrienoate|9Z,12Z,15Z-octadecatrienoic acid|(9,12,15)-linolenate}}
+
{{#set: common name=(6z,8e,10e,14z)-(5s,12r)-5,12-dihydroxyicosa-6,8,10,14-tetraenoate}}
−
{{#set: consumed by=RXN-1321|LINOLENOYL-RXN|RXN-8497}}
+
{{#set: produced by=LEUKOTRIENE-A4-HYDROLASE-RXN}}
−
{{#set: produced by=RXN-1501_METACYC18.5}}
+
−
{{#set: reversible reaction associated=R07861}}
+

Revision as of 14:20, 21 March 2018

Metabolite 6Z8E10E14Z-5S12R-512-DIHYDROXYI

  • smiles:
    • CCCCCC=CCC(O)C=CC=CC=CC(O)CCCC(=O)[O-]
  • inchi key:
    • InChIKey=VNYSSYRCGWBHLG-AMOLWHMGSA-M
  • common name:
    • leukotriene B4
  • molecular weight:
    • 335.462
  • Synonym(s):
    • (6z,8e,10e,14z)-(5s,12r)-5,12-dihydroxyicosa-6,8,10,14-tetraenoate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 71160-24-2
  • PUBCHEM:
  • HMDB : HMDB01085
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC57461
"CCCCCC=CCC(O)C=CC=CC=CC(O)CCCC(=O)[O-" cannot be used as a page name in this wiki.



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