Difference between revisions of "CPD-19172"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACETYL-GLU ACETYL-GLU] == * smiles: ** CC(=O)NC(C([O-])=O)CCC(=O)[O-] * inchi key: ** InChIKey=...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19172 CPD-19172] == * smiles: ** CCCCCCCCC=CCCCCCC=CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O...")
 
(One intermediate revision by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ACETYL-GLU ACETYL-GLU] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-19172 CPD-19172] ==
 
* smiles:
 
* smiles:
−
** CC(=O)NC(C([O-])=O)CCC(=O)[O-]
+
** CCCCCCCCC=CCCCCCC=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-]
 
* inchi key:
 
* inchi key:
−
** InChIKey=RFMMMVDNIPUKGG-YFKPBYRVSA-L
+
** InChIKey=REOYMONHGHULEY-PPSVNWDXSA-J
 
* common name:
 
* common name:
−
** N-acetyl-L-glutamate
+
** (2E,9Z)-octadecenoyl-CoA
 
* molecular weight:
 
* molecular weight:
−
** 187.152    
+
** 1025.937    
 
* Synonym(s):
 
* Synonym(s):
−
** N-acetyl-L-glutamic acid
+
** 18:2-Δ2,Δ9-CoA
−
** acetyl-L-glu
+
** 2-trans,9-cis-octadecenoyl-CoA
−
** acetyl-L-glutamate
+
−
** NAG
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-17776]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[GLUTAMATE-N-ACETYLTRANSFERASE-RXN]]
+
* [[RXN-17775]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[N-ACETYLTRANSFER-RXN]]
 
−
* [[ACETYLGLUTKIN-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 1188-37-0
+
{{#set: smiles=CCCCCCCCC=CCCCCCC=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-]}}
−
* BIGG : 35520
+
{{#set: inchi key=InChIKey=REOYMONHGHULEY-PPSVNWDXSA-J}}
−
* PUBCHEM:
+
{{#set: common name=(2E,9Z)-octadecenoyl-CoA}}
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=1549099 1549099]
+
{{#set: molecular weight=1025.937   }}
−
* HMDB : HMDB01138
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{{#set: common name=18:2-Δ2,Δ9-CoA|2-trans,9-cis-octadecenoyl-CoA}}
−
* LIGAND-CPD:
+
{{#set: consumed by=RXN-17776}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C00624 C00624]
+
{{#set: produced by=RXN-17775}}
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.1266066.html 1266066]
+
−
* CHEBI:
+
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=44337 44337]
+
−
* METABOLIGHTS : MTBLC44337
+
−
{{#set: smiles=CC(=O)NC(C([O-])=O)CCC(=O)[O-]}}
+
−
{{#set: inchi key=InChIKey=RFMMMVDNIPUKGG-YFKPBYRVSA-L}}
+
−
{{#set: common name=N-acetyl-L-glutamate}}
+
−
{{#set: molecular weight=187.152   }}
+
−
{{#set: common name=N-acetyl-L-glutamic acid|acetyl-L-glu|acetyl-L-glutamate|NAG}}
+
−
{{#set: produced by=GLUTAMATE-N-ACETYLTRANSFERASE-RXN}}
+
−
{{#set: reversible reaction associated=N-ACETYLTRANSFER-RXN|ACETYLGLUTKIN-RXN}}
+

Latest revision as of 20:58, 21 March 2018

Metabolite CPD-19172

  • smiles:
    • CCCCCCCCC=CCCCCCC=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-]
  • inchi key:
    • InChIKey=REOYMONHGHULEY-PPSVNWDXSA-J
  • common name:
    • (2E,9Z)-octadecenoyl-CoA
  • molecular weight:
    • 1025.937
  • Synonym(s):
    • 18:2-Δ2,Δ9-CoA
    • 2-trans,9-cis-octadecenoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCC=CCCCCCC=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-" cannot be used as a page name in this wiki.




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