Difference between revisions of "CPD-12601"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=LINOLENOYL-COA LINOLENOYL-COA] == * smiles: ** CCC=CCC=CCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12601 CPD-12601] == * smiles: ** C(O)C1(C(O)C(O)C(O)C(O)O1) * common name: ** β-D-mann...")
 
(2 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=LINOLENOYL-COA LINOLENOYL-COA] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12601 CPD-12601] ==
 
* smiles:
 
* smiles:
−
** CCC=CCC=CCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC3(OC(N2(C=NC1(C(N)=NC=NC=12)))C(O)C(OP(=O)([O-])[O-])3)
+
** C(O)C1(C(O)C(O)C(O)C(O)O1)
−
* inchi key:
+
−
** InChIKey=OMKFKBGZHNJNEX-KZWMEWPFSA-J
+
 
* common name:
 
* common name:
−
** α-linolenoyl-CoA
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** β-D-mannopyranose
 +
* inchi key:
 +
** InChIKey=WQZGKKKJIJFFOK-RWOPYEJCSA-N
 
* molecular weight:
 
* molecular weight:
−
** 1023.921    
+
** 180.157    
 
* Synonym(s):
 
* Synonym(s):
−
** 18:3Δ9,12,15
 
−
** (9Z,12Z,15Z)-octadecatrienoyl-CoA
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[FACOAE1839Z12Z15Z]]
 
−
* [[RXN-13441]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[LINOLENOYL-RXN]]
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* [[RXN-14501]]
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* [[LNLNCACOAL]]
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* [[3.2.1.25-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* DRUGBANK : DB02687
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=439680 439680]
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C16162 C16162]
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** [http://www.genome.jp/dbget-bin/www_bget?C02209 C02209]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.388747.html 388747]
 
* CHEBI:
 
* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=51985 51985]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28563 28563]
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* METABOLIGHTS : MTBLC51985
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* METABOLIGHTS : MTBLC28563
−
* PUBCHEM:
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{{#set: smiles=C(O)C1(C(O)C(O)C(O)C(O)O1)}}
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=49859601 49859601]
+
{{#set: common name=β-D-mannopyranose}}
−
* HMDB : HMDB06290
+
{{#set: inchi key=InChIKey=WQZGKKKJIJFFOK-RWOPYEJCSA-N}}
−
{{#set: smiles=CCC=CCC=CCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OCC3(OC(N2(C=NC1(C(N)=NC=NC=12)))C(O)C(OP(=O)([O-])[O-])3)}}
+
{{#set: molecular weight=180.157    }}
−
{{#set: inchi key=InChIKey=OMKFKBGZHNJNEX-KZWMEWPFSA-J}}
+
{{#set: produced by=RXN-14501|3.2.1.25-RXN}}
−
{{#set: common name=α-linolenoyl-CoA}}
+
−
{{#set: molecular weight=1023.921    }}
+
−
{{#set: common name=18:3Δ9,12,15|(9Z,12Z,15Z)-octadecatrienoyl-CoA}}
+
−
{{#set: consumed by=FACOAE1839Z12Z15Z|RXN-13441}}
+
−
{{#set: produced by=LINOLENOYL-RXN|LNLNCACOAL}}
+

Latest revision as of 20:46, 21 March 2018

Metabolite CPD-12601

  • smiles:
    • C(O)C1(C(O)C(O)C(O)C(O)O1)
  • common name:
    • β-D-mannopyranose
  • inchi key:
    • InChIKey=WQZGKKKJIJFFOK-RWOPYEJCSA-N
  • molecular weight:
    • 180.157
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links



Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=CPD-12601&oldid=43617"