Difference between revisions of "CPD-10244"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13713 CPD-13713] == * smiles: ** C(C3(C(C(C(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O)O))OP(=O)([O-])...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10244 CPD-10244] == * smiles: ** CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)[O-] * common name: ** doc...")
 
(2 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13713 CPD-13713] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10244 CPD-10244] ==
 
* smiles:
 
* smiles:
−
** C(C3(C(C(C(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O)O))OP(=O)([O-])O[Se](=O)(=O)O
+
** CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)[O-]
−
* inchi key:
+
−
** InChIKey=XCADVMZZFPIERR-KQYNXXCUSA-M
+
 
* common name:
 
* common name:
−
** adenosine 5'-phosphoselenate
+
** docosahexaenoate
 +
* inchi key:
 +
** InChIKey=MBMBGCFOFBJSGT-KUBAVDMBSA-M
 
* molecular weight:
 
* molecular weight:
−
** 473.174    
+
** 327.486    
 
* Synonym(s):
 
* Synonym(s):
−
** adenylyl-selenate
+
** docosahexaenoic acid
−
** APSe
+
** DHA
−
** adenosine phosphoselenate
+
** all-cis-docosa-4,7,10,13,16,19-hexaenoate
−
** adenylylselenate
+
** (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate
−
** adenosine-5'-phosphoselenate
+
** (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-12720]]
+
* [[RXN-16138]]
 +
* [[RXN-16017]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-16063]]
 
== External links  ==
 
== External links  ==
 +
* LIPID_MAPS : LMFA01030185
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657723 90657723]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=40486925 40486925]
 +
* DRUGBANK : DB03756
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=2485 2485]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=77016 77016]
−
* LIGAND-CPD:
+
* HMDB : HMDB02183
−
** [http://www.genome.jp/dbget-bin/www_bget?C05686 C05686]
+
{{#set: smiles=CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)[O-]}}
−
* HMDB : HMDB04112
+
{{#set: common name=docosahexaenoate}}
−
{{#set: smiles=C(C3(C(C(C(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O)O))OP(=O)([O-])O[Se](=O)(=O)O}}
+
{{#set: inchi key=InChIKey=MBMBGCFOFBJSGT-KUBAVDMBSA-M}}
−
{{#set: inchi key=InChIKey=XCADVMZZFPIERR-KQYNXXCUSA-M}}
+
{{#set: molecular weight=327.486   }}
−
{{#set: common name=adenosine 5'-phosphoselenate}}
+
{{#set: common name=docosahexaenoic acid|DHA|all-cis-docosa-4,7,10,13,16,19-hexaenoate|(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate|(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate}}
−
{{#set: molecular weight=473.174   }}
+
{{#set: produced by=RXN-16138|RXN-16017}}
−
{{#set: common name=adenylyl-selenate|APSe|adenosine phosphoselenate|adenylylselenate|adenosine-5'-phosphoselenate}}
+
{{#set: reversible reaction associated=RXN-16063}}
−
{{#set: produced by=RXN-12720}}
+

Latest revision as of 21:17, 21 March 2018

Metabolite CPD-10244

  • smiles:
    • CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)[O-]
  • common name:
    • docosahexaenoate
  • inchi key:
    • InChIKey=MBMBGCFOFBJSGT-KUBAVDMBSA-M
  • molecular weight:
    • 327.486
  • Synonym(s):
    • docosahexaenoic acid
    • DHA
    • all-cis-docosa-4,7,10,13,16,19-hexaenoate
    • (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate
    • (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIPID_MAPS : LMFA01030185
  • PUBCHEM:
  • DRUGBANK : DB03756
  • CHEBI:
  • HMDB : HMDB02183
"CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)[O-" cannot be used as a page name in this wiki.




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