Difference between revisions of "CPD-2750"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=N-5S-5-AMINO-5-CARBOXYPENTANOYL-L-CY N-5S-5-AMINO-5-CARBOXYPENTANOYL-L-CY] == * smiles: ** CC(C...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-2750 CPD-2750] == * smiles: ** C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2)) * inchi key: ** InChIK...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=N-5S-5-AMINO-5-CARBOXYPENTANOYL-L-CY N-5S-5-AMINO-5-CARBOXYPENTANOYL-L-CY] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-2750 CPD-2750] ==
 
* smiles:
 
* smiles:
−
** CC(C)C(NC(=O)C(NC(=O)CCCC([N+])C(=O)[O-])CS)C(=O)[O-]
+
** C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2))
 
* inchi key:
 
* inchi key:
−
** InChIKey=BYEIJZFKOAXBBV-QXEWZRGKSA-M
+
** InChIKey=XOKCJXZZNAUIQN-DTWKUNHWSA-N
 
* common name:
 
* common name:
−
** N-[(5S)-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine
+
** trans-3'-hydroxycotinine
 
* molecular weight:
 
* molecular weight:
−
** 362.42    
+
** 192.217    
 
* Synonym(s):
 
* Synonym(s):
−
** ACV
 
−
** L-δ-(α-aminoadipoyl)-L-cysteinyl-D-valine
 
−
** δ(L-2-aminoadipyl)-L-cysteinyl-D-valine
 
−
** N-[L-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[1.21.3.1-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN66-161]]
 
== 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=91820470 91820470]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=107963 107963]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.97080.html 97080]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58572 58572]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=71182 71182]
−
* LIGAND-CPD:
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* METABOLIGHTS : MTBLC71182
−
** [http://www.genome.jp/dbget-bin/www_bget?C05556 C05556]
+
* HMDB : HMDB01390
−
{{#set: smiles=CC(C)C(NC(=O)C(NC(=O)CCCC([N+])C(=O)[O-])CS)C(=O)[O-]}}
+
{{#set: smiles=C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2))}}
−
{{#set: inchi key=InChIKey=BYEIJZFKOAXBBV-QXEWZRGKSA-M}}
+
{{#set: inchi key=InChIKey=XOKCJXZZNAUIQN-DTWKUNHWSA-N}}
−
{{#set: common name=N-[(5S)-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine}}
+
{{#set: common name=trans-3'-hydroxycotinine}}
−
{{#set: molecular weight=362.42   }}
+
{{#set: molecular weight=192.217   }}
−
{{#set: common name=ACV|L-δ-(α-aminoadipoyl)-L-cysteinyl-D-valine|δ(L-2-aminoadipyl)-L-cysteinyl-D-valine|N-[L-5-amino-5-carboxypentanoyl]-L-cysteinyl-D-valine}}
+
{{#set: produced by=RXN66-161}}
−
{{#set: consumed by=1.21.3.1-RXN}}
+

Latest revision as of 19:59, 21 March 2018

Metabolite CPD-2750

  • smiles:
    • C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2))
  • inchi key:
    • InChIKey=XOKCJXZZNAUIQN-DTWKUNHWSA-N
  • common name:
    • trans-3'-hydroxycotinine
  • molecular weight:
    • 192.217
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC71182
  • HMDB : HMDB01390
"C1(=O)(C(O)C[CH](N(C)1)C2(C=NC=CC=2))" cannot be used as a page name in this wiki.



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