Difference between revisions of "CPD-11281"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-237 CPD-237] == * smiles: ** C1(=C(CC(N)=O)C2(=CC=CC=C(N1)2)) * inchi key: ** InChIKey=ZOAM...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11281 CPD-11281] == * smiles: ** C(SS)C(C(NCC([O-])=O)=O)NC(=O)CCC([N+])C([O-])=O * inchi k...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-237 CPD-237] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11281 CPD-11281] ==
 
* smiles:
 
* smiles:
** C1(=C(CC(N)=O)C2(=CC=CC=C(N1)2))
+
** C(SS)C(C(NCC([O-])=O)=O)NC(=O)CCC([N+])C([O-])=O
 
* inchi key:
 
* inchi key:
** InChIKey=ZOAMBXDOGPRZLP-UHFFFAOYSA-N
+
** InChIKey=QBOLVLBSUGJHGB-WDSKDSINSA-M
 
* common name:
 
* common name:
** indole-3-acetamide
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** S-sulfanylglutathione
 
* molecular weight:
 
* molecular weight:
** 174.202    
+
** 338.373    
 
* Synonym(s):
 
* Synonym(s):
** 1H-indole-3-acetamide
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** GSSH
** indoleacetamide
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** glutathione-sulfide
** (indol-3-yl)acetamide
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** glutathione persulfide
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXNN-404]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-15348]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-10851]]
 
== External links  ==
 
== External links  ==
* CAS : 879-37-8
 
* DRUGBANK : DB08652
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=397 397]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46878477 46878477]
* HMDB : HMDB29739
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C02693 C02693]
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* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.386.html 386]
+
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16031 16031]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58905 58905]
* METABOLIGHTS : MTBLC16031
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* LIGAND-CPD:
{{#set: smiles=C1(=C(CC(N)=O)C2(=CC=CC=C(N1)2))}}
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** [http://www.genome.jp/dbget-bin/www_bget?C17267 C17267]
{{#set: inchi key=InChIKey=ZOAMBXDOGPRZLP-UHFFFAOYSA-N}}
+
{{#set: smiles=C(SS)C(C(NCC([O-])=O)=O)NC(=O)CCC([N+])C([O-])=O}}
{{#set: common name=indole-3-acetamide}}
+
{{#set: inchi key=InChIKey=QBOLVLBSUGJHGB-WDSKDSINSA-M}}
{{#set: molecular weight=174.202   }}
+
{{#set: common name=S-sulfanylglutathione}}
{{#set: common name=1H-indole-3-acetamide|indoleacetamide|(indol-3-yl)acetamide}}
+
{{#set: molecular weight=338.373   }}
{{#set: consumed by=RXNN-404}}
+
{{#set: common name=GSSH|glutathione-sulfide|glutathione persulfide}}
 +
{{#set: produced by=RXN-15348}}
 +
{{#set: reversible reaction associated=RXN-10851}}

Latest revision as of 19:31, 21 March 2018

Metabolite CPD-11281

  • smiles:
    • C(SS)C(C(NCC([O-])=O)=O)NC(=O)CCC([N+])C([O-])=O
  • inchi key:
    • InChIKey=QBOLVLBSUGJHGB-WDSKDSINSA-M
  • common name:
    • S-sulfanylglutathione
  • molecular weight:
    • 338.373
  • Synonym(s):
    • GSSH
    • glutathione-sulfide
    • glutathione persulfide

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C(SS)C(C(NCC([O-])=O)=O)NC(=O)CCC([N+])C([O-])=O" cannot be used as a page name in this wiki.