Difference between revisions of "CYSTINE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPDQT-28 CPDQT-28] == * smiles: ** CSCCCCCC(=O)C([O-])=O * inchi key: ** InChIKey=TWAIOPPFLZEXC...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12906 CPD-12906] == * smiles: ** CC(C)=CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPDQT-28 CPDQT-28] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12906 CPD-12906] ==
 
* smiles:
 
* smiles:
** CSCCCCCC(=O)C([O-])=O
+
** CC(C)=CC(=O)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=TWAIOPPFLZEXCO-UHFFFAOYSA-M
+
** InChIKey=ZFKZVSUJTDSJEY-SVHODSNWSA-J
 
* common name:
 
* common name:
** 7-(methylthio)-2-oxoheptanoate
+
** 5-methyl-3-oxo-4-hexenoyl-CoA
 
* molecular weight:
 
* molecular weight:
** 189.249    
+
** 887.641    
 
* Synonym(s):
 
* Synonym(s):
** 7-(methylthio)-2-oxoheptanoic acid
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-11921]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXNQT-4168]]
 
* [[RXN-18207]]
 
 
== 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=44237184 44237184]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=50986120 50986120]
* KNAPSACK : C00007645
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* LIGAND-CPD:
{{#set: smiles=CSCCCCCC(=O)C([O-])=O}}
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** [http://www.genome.jp/dbget-bin/www_bget?C16471 C16471]
{{#set: inchi key=InChIKey=TWAIOPPFLZEXCO-UHFFFAOYSA-M}}
+
* HMDB : HMDB60399
{{#set: common name=7-(methylthio)-2-oxoheptanoate}}
+
{{#set: smiles=CC(C)=CC(=O)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-]}}
{{#set: molecular weight=189.249   }}
+
{{#set: inchi key=InChIKey=ZFKZVSUJTDSJEY-SVHODSNWSA-J}}
{{#set: common name=7-(methylthio)-2-oxoheptanoic acid}}
+
{{#set: common name=5-methyl-3-oxo-4-hexenoyl-CoA}}
{{#set: produced by=RXNQT-4168|RXN-18207}}
+
{{#set: molecular weight=887.641   }}
 +
{{#set: consumed by=RXN-11921}}

Revision as of 18:09, 18 March 2018

Metabolite CPD-12906

  • smiles:
    • CC(C)=CC(=O)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=ZFKZVSUJTDSJEY-SVHODSNWSA-J
  • common name:
    • 5-methyl-3-oxo-4-hexenoyl-CoA
  • molecular weight:
    • 887.641
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)=CC(=O)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.