Difference between revisions of "CPD-13533"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13533 CPD-13533] == * smiles: ** CCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C(C1OP([O-])...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14705 CPD-14705] == * smiles: ** CCCCCC(O)C(C[CH]=O)SCC([N+])C(=O)NCC([O-])=O * common name...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-13533 CPD-13533] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14705 CPD-14705] ==
 
* smiles:
 
* smiles:
** CCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C(C1OP([O-])([O-])=O)O)N3(C=NC2(C(=NC=NC=23)N))))([O-])=O)(C)C)O)=O)=O)=O)O
+
** CCCCCC(O)C(C[CH]=O)SCC([N+])C(=O)NCC([O-])=O
* inchi key:
+
** InChIKey=YYGYPCRWZMLSGK-ORUMCERNSA-J
+
 
* common name:
 
* common name:
** (R)-3-hydroxyvaleryl-CoA
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** 4-hydroxy-2-nonenal-[Cys-Gly] conjugate
 +
* inchi key:
 +
** InChIKey=LQTWZQSULMRBEE-UHFFFAOYSA-N
 
* molecular weight:
 
* molecular weight:
** 863.619    
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** 334.43    
 
* Synonym(s):
 
* Synonym(s):
** D-β-hydroxyvaleryl-CoA
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-13677]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[RXN-12560]]
 
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54758578 54758578]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90659346 90659346]
{{#set: smiles=CCC(CC(SCCNC(CCNC(C(C(COP(=O)([O-])OP(OCC1(OC(C(C1OP([O-])([O-])=O)O)N3(C=NC2(C(=NC=NC=23)N))))([O-])=O)(C)C)O)=O)=O)=O)O}}
+
{{#set: smiles=CCCCCC(O)C(C[CH]=O)SCC([N+])C(=O)NCC([O-])=O}}
{{#set: inchi key=InChIKey=YYGYPCRWZMLSGK-ORUMCERNSA-J}}
+
{{#set: common name=4-hydroxy-2-nonenal-[Cys-Gly] conjugate}}
{{#set: common name=(R)-3-hydroxyvaleryl-CoA}}
+
{{#set: inchi key=InChIKey=LQTWZQSULMRBEE-UHFFFAOYSA-N}}
{{#set: molecular weight=863.619   }}
+
{{#set: molecular weight=334.43   }}
{{#set: common name=D-β-hydroxyvaleryl-CoA}}
+
{{#set: consumed by=RXN-13677}}
{{#set: reversible reaction associated=RXN-12560}}
+

Revision as of 15:36, 21 March 2018

Metabolite CPD-14705

  • smiles:
    • CCCCCC(O)C(C[CH]=O)SCC([N+])C(=O)NCC([O-])=O
  • common name:
    • 4-hydroxy-2-nonenal-[Cys-Gly] conjugate
  • inchi key:
    • InChIKey=LQTWZQSULMRBEE-UHFFFAOYSA-N
  • molecular weight:
    • 334.43
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCC(O)C(C[CH]=O)SCC([N+])C(=O)NCC([O-])=O" cannot be used as a page name in this wiki.
"4-hydroxy-2-nonenal-[Cys-Gly] conjugate" cannot be used as a page name in this wiki.