Difference between revisions of "CPD-8892"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=THZ THZ] == * smiles: ** CC1(N=CSC(CCO)=1) * inchi key: ** InChIKey=BKAWJIRCKVUVED-UHFFFAOYSA-N...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8892 CPD-8892] == * smiles: ** CCCCCC=CCC=CC=CC=C[CH]1(O[CH]1CCCC(=O)[O-]) * inchi key: **...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=THZ THZ] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8892 CPD-8892] ==
 
* smiles:
 
* smiles:
** CC1(N=CSC(CCO)=1)
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** CCCCCC=CCC=CC=CC=C[CH]1(O[CH]1CCCC(=O)[O-])
 
* inchi key:
 
* inchi key:
** InChIKey=BKAWJIRCKVUVED-UHFFFAOYSA-N
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** InChIKey=UFPQIRYSPUYQHK-XWYPZHSRSA-M
 
* common name:
 
* common name:
** 5-(2-hydroxyethyl)-4-methylthiazole
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** leukotriene A4
 
* molecular weight:
 
* molecular weight:
** 143.203    
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** 317.447    
 
* Synonym(s):
 
* Synonym(s):
** 4-methyl-5-(2-hydroxyethyl)-thiazole
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** leukotriene A(4)
** THZ
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** (7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyicosa-7,9,11,14-tetraenoate
** 4-methyl-5-(β-hydroxyethyl)thiazole
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** LTA4
** HET
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== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[THIAZOLSYN3-RXN]]
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* [[LEUKOTRIENE-A4-HYDROLASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* CAS : 137-00-8
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* CAS : 72059-45-1
* METABOLIGHTS : MTBLC17957
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* DRUGBANK : DB02969
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* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=1136 1136]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91819769 91819769]
* HMDB : HMDB32985
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* HMDB : HMDB01337
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C04294 C04294]
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** [http://www.genome.jp/dbget-bin/www_bget?C00909 C00909]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.1104.html 1104]
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** [http://www.chemspider.com/Chemical-Structure.20117934.html 20117934]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17957 17957]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57463 57463]
* BIGG : 4mhetz
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* METABOLIGHTS : MTBLC57463
{{#set: smiles=CC1(N=CSC(CCO)=1)}}
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{{#set: smiles=CCCCCC=CCC=CC=CC=C[CH]1(O[CH]1CCCC(=O)[O-])}}
{{#set: inchi key=InChIKey=BKAWJIRCKVUVED-UHFFFAOYSA-N}}
+
{{#set: inchi key=InChIKey=UFPQIRYSPUYQHK-XWYPZHSRSA-M}}
{{#set: common name=5-(2-hydroxyethyl)-4-methylthiazole}}
+
{{#set: common name=leukotriene A4}}
{{#set: molecular weight=143.203   }}
+
{{#set: molecular weight=317.447   }}
{{#set: common name=4-methyl-5-(2-hydroxyethyl)-thiazole|THZ|4-methyl-5-(β-hydroxyethyl)thiazole|HET}}
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{{#set: common name=leukotriene A(4)|(7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyicosa-7,9,11,14-tetraenoate|LTA4}}
{{#set: consumed by=THIAZOLSYN3-RXN}}
+
{{#set: consumed by=LEUKOTRIENE-A4-HYDROLASE-RXN}}

Revision as of 17:06, 23 May 2018

Metabolite CPD-8892

  • smiles:
    • CCCCCC=CCC=CC=CC=C[CH]1(O[CH]1CCCC(=O)[O-])
  • inchi key:
    • InChIKey=UFPQIRYSPUYQHK-XWYPZHSRSA-M
  • common name:
    • leukotriene A4
  • molecular weight:
    • 317.447
  • Synonym(s):
    • leukotriene A(4)
    • (7E,9E,11Z,14Z)-(5S,6S)-5,6-epoxyicosa-7,9,11,14-tetraenoate
    • LTA4

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCC=CCC=CC=CC=C[CH]1(O[CH]1CCCC(=O)[O-])" cannot be used as a page name in this wiki.