Difference between revisions of "CPD-14594"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=T2-DECENOYL-COA T2-DECENOYL-COA] == * smiles: ** CCCCCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14594 CPD-14594] == * smiles: ** CC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=T2-DECENOYL-COA T2-DECENOYL-COA] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14594 CPD-14594] ==
 
* smiles:
 
* smiles:
−
** CCCCCCCC=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-]
+
** CC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C
−
* inchi key:
+
−
** InChIKey=MGNBGCRQQFMNBM-YJHHLLFWSA-J
+
 
* common name:
 
* common name:
−
** trans-dec-2-enoyl-CoA
+
** linustatin
 +
* inchi key:
 +
** InChIKey=FERSMFQBWVBKQK-CXTTVELOSA-N
 
* molecular weight:
 
* molecular weight:
−
** 915.738    
+
** 409.389    
 
* Synonym(s):
 
* Synonym(s):
−
** 2E-decenoyl-CoA
+
** propanenitrile
−
** 2-trans-decenoyl-CoA
+
** [2-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyloxy)-2-methylpropiononitrile)]
−
** trans-Δ2-decenoyl-CoA
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-13616]]
+
* [[RXN-13602]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-13615]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* BIGG : dc2coa
 
−
* PUBCHEM:
 
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=50909850 50909850]
 
−
* HMDB : HMDB03948
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C05275 C05275]
+
** [http://www.genome.jp/dbget-bin/www_bget?C08333 C08333]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=61406 61406]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=6483 6483]
−
* METABOLIGHTS : MTBLC61406
+
* PUBCHEM:
−
{{#set: smiles=CCCCCCCC=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-]}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=119301 119301]
−
{{#set: inchi key=InChIKey=MGNBGCRQQFMNBM-YJHHLLFWSA-J}}
+
{{#set: smiles=CC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C}}
−
{{#set: common name=trans-dec-2-enoyl-CoA}}
+
{{#set: common name=linustatin}}
−
{{#set: molecular weight=915.738   }}
+
{{#set: inchi key=InChIKey=FERSMFQBWVBKQK-CXTTVELOSA-N}}
−
{{#set: common name=2E-decenoyl-CoA|2-trans-decenoyl-CoA|trans-Δ2-decenoyl-CoA}}
+
{{#set: molecular weight=409.389   }}
−
{{#set: consumed by=RXN-13616}}
+
{{#set: common name=propanenitrile|[2-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyloxy)-2-methylpropiononitrile)]}}
−
{{#set: produced by=RXN-13615}}
+
{{#set: consumed by=RXN-13602}}

Latest revision as of 20:13, 21 March 2018

Metabolite CPD-14594

  • smiles:
    • CC(OC2(OC(COC1(OC(CO)C(O)C(O)C(O)1))C(O)C(O)C(O)2))(C#N)C
  • common name:
    • linustatin
  • inchi key:
    • InChIKey=FERSMFQBWVBKQK-CXTTVELOSA-N
  • molecular weight:
    • 409.389
  • Synonym(s):
    • propanenitrile
    • [2-(6-O-β-D-glucopyranosyl-β-D-glucopyranosyloxy)-2-methylpropiononitrile)]

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-14594&oldid=46911"