Difference between revisions of "OAAAKGtm"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11520 CPD-11520] == * smiles: ** CCC=CCC4(C(=O)CCC(CCCCCC(=O)CC(SCCNC(=O)CCNC(=O)C(O)C(C)(C...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPDQT-30 CPDQT-30] == * smiles: ** CSCCCCCCCC(=O)C([O-])=O * common name: ** 9-(methylthio)-2-o...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11520 CPD-11520] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPDQT-30 CPDQT-30] ==
 
* smiles:
 
* smiles:
** CCC=CCC4(C(=O)CCC(CCCCCC(=O)CC(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-])=O)4)
+
** CSCCCCCCCC(=O)C([O-])=O
* inchi key:
+
** InChIKey=YYCCMACTOAJGGW-LHVXMLCWSA-J
+
 
* common name:
 
* common name:
** OPC8-3-ketoacyl-CoA
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** 9-(methylthio)-2-oxononanoate
 +
* inchi key:
 +
** InChIKey=MJGXIOUQXYXGLP-UHFFFAOYSA-M
 
* molecular weight:
 
* molecular weight:
** 1053.904    
+
** 217.302    
 
* Synonym(s):
 
* Synonym(s):
 +
** 9-(methylthio)-2-oxononanoic acid
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-10699]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-10698]]
+
* [[RXN-18203]]
 +
* [[RXNQT-4174]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44237200 44237200]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44237169 44237169]
{{#set: smiles=CCC=CCC4(C(=O)CCC(CCCCCC(=O)CC(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-])=O)4)}}
+
* KNAPSACK : C00007654
{{#set: inchi key=InChIKey=YYCCMACTOAJGGW-LHVXMLCWSA-J}}
+
{{#set: smiles=CSCCCCCCCC(=O)C([O-])=O}}
{{#set: common name=OPC8-3-ketoacyl-CoA}}
+
{{#set: common name=9-(methylthio)-2-oxononanoate}}
{{#set: molecular weight=1053.904   }}
+
{{#set: inchi key=InChIKey=MJGXIOUQXYXGLP-UHFFFAOYSA-M}}
{{#set: consumed by=RXN-10699}}
+
{{#set: molecular weight=217.302   }}
{{#set: produced by=RXN-10698}}
+
{{#set: common name=9-(methylthio)-2-oxononanoic acid}}
 +
{{#set: produced by=RXN-18203|RXNQT-4174}}

Revision as of 15:57, 21 March 2018

Metabolite CPDQT-30

  • smiles:
    • CSCCCCCCCC(=O)C([O-])=O
  • common name:
    • 9-(methylthio)-2-oxononanoate
  • inchi key:
    • InChIKey=MJGXIOUQXYXGLP-UHFFFAOYSA-M
  • molecular weight:
    • 217.302
  • Synonym(s):
    • 9-(methylthio)-2-oxononanoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • KNAPSACK : C00007654
"CSCCCCCCCC(=O)C([O-])=O" cannot be used as a page name in this wiki.