Difference between revisions of "PWY66-368"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17641 CPD-17641] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCCCCCCCO)COP(=O)...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CREATINE CREATINE] == * smiles: ** C(C(=O)[O-])N(C)C(N)=[N+] * inchi key: ** InChIKey=CVSVTCORW...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17641 CPD-17641] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CREATINE CREATINE] ==
 
* smiles:
 
* smiles:
−
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCCCCCCCO)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-]
+
** C(C(=O)[O-])N(C)C(N)=[N+]
 
* inchi key:
 
* inchi key:
−
** InChIKey=WMNWNRKMANJLHY-LFZQUHGESA-J
+
** InChIKey=CVSVTCORWBXHQV-UHFFFAOYSA-N
 
* common name:
 
* common name:
−
** 18-hydroxystearoyl-CoA
+
** creatine
 
* molecular weight:
 
* molecular weight:
−
** 1045.968    
+
** 131.134    
 
* Synonym(s):
 
* Synonym(s):
−
** ω-hydroxy-octadecanoyl-coenzyme A
+
** methylguanidinoacetic acid
−
** ω-hydroxystearoyl-CoA
+
** N-amidinosarcosine
−
** 18-hydroxy-octadecanoyl-CoA
+
** methylglycocyamine
 +
** N-methyl-N-guanylglycine
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[CREATINASE-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-16401]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[CREATINE-KINASE-RXN]]
 
== External links  ==
 
== External links  ==
 +
* CAS : 57-00-1
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91819832 91819832]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=7058172 7058172]
−
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCCCCCCCO)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-]}}
+
* HMDB : HMDB00064
−
{{#set: inchi key=InChIKey=WMNWNRKMANJLHY-LFZQUHGESA-J}}
+
* LIGAND-CPD:
−
{{#set: common name=18-hydroxystearoyl-CoA}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C00300 C00300]
−
{{#set: molecular weight=1045.968   }}
+
* CHEMSPIDER:
−
{{#set: common name=ω-hydroxy-octadecanoyl-coenzyme A|ω-hydroxystearoyl-CoA|18-hydroxy-octadecanoyl-CoA}}
+
** [http://www.chemspider.com/Chemical-Structure.5414502.html 5414502]
−
{{#set: produced by=RXN-16401}}
+
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57947 57947]
 +
* METABOLIGHTS : MTBLC57947
 +
{{#set: smiles=C(C(=O)[O-])N(C)C(N)=[N+]}}
 +
{{#set: inchi key=InChIKey=CVSVTCORWBXHQV-UHFFFAOYSA-N}}
 +
{{#set: common name=creatine}}
 +
{{#set: molecular weight=131.134   }}
 +
{{#set: common name=methylguanidinoacetic acid|N-amidinosarcosine|methylglycocyamine|N-methyl-N-guanylglycine}}
 +
{{#set: consumed by=CREATINASE-RXN}}
 +
{{#set: reversible reaction associated=CREATINE-KINASE-RXN}}

Revision as of 20:49, 17 March 2018

Metabolite CREATINE

  • smiles:
    • C(C(=O)[O-])N(C)C(N)=[N+]
  • inchi key:
    • InChIKey=CVSVTCORWBXHQV-UHFFFAOYSA-N
  • common name:
    • creatine
  • molecular weight:
    • 131.134
  • Synonym(s):
    • methylguanidinoacetic acid
    • N-amidinosarcosine
    • methylglycocyamine
    • N-methyl-N-guanylglycine

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 57-00-1
  • PUBCHEM:
  • HMDB : HMDB00064
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC57947
"C(C(=O)[O-])N(C)C(N)=[N+" cannot be used as a page name in this wiki.




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