Difference between revisions of "5-HYDROXYINDOLE ACETALDEHYDE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXYADIPYL-COA 3-HYDROXYADIPYL-COA] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=5-HYDROXYINDOLE_ACETALDEHYDE 5-HYDROXYINDOLE_ACETALDEHYDE] == * smiles: ** C1(NC2(C(C(CC=O)=1)=...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXYADIPYL-COA 3-HYDROXYADIPYL-COA] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=5-HYDROXYINDOLE_ACETALDEHYDE 5-HYDROXYINDOLE_ACETALDEHYDE] ==
 
* smiles:
 
* smiles:
−
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O)[O-])O)=O)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-]
+
** C1(NC2(C(C(CC=O)=1)=CC(=CC=2)O))
 
* inchi key:
 
* inchi key:
−
** InChIKey=OTEACGAEDCIMBS-NOTSHUFBSA-I
+
** InChIKey=OBFAPCIUSYHFIE-UHFFFAOYSA-N
 
* common name:
 
* common name:
−
** (3S)-hydroxyadipyl-CoA
+
** 5-hydroxyindole acetaldehyde
 
* molecular weight:
 
* molecular weight:
−
** 906.621    
+
** 175.187    
 
* Synonym(s):
 
* Synonym(s):
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-10780]]
 
== 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-2425]]
 
−
* [[RXN0-2044]]
 
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=70679061 70679061]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=74688 74688]
−
* CHEBI:
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* HMDB : HMDB04073
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=70990 70990]
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C14145 C14145]
+
** [http://www.genome.jp/dbget-bin/www_bget?C05634 C05634]
−
* HMDB : HMDB12475
+
* CHEMSPIDER:
−
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CC(CCC(=O)[O-])O)=O)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-]}}
+
** [http://www.chemspider.com/Chemical-Structure.67261.html 67261]
−
{{#set: inchi key=InChIKey=OTEACGAEDCIMBS-NOTSHUFBSA-I}}
+
* CHEBI:
−
{{#set: common name=(3S)-hydroxyadipyl-CoA}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=50157 50157]
−
{{#set: molecular weight=906.621   }}
+
* METABOLIGHTS : MTBLC50157
−
{{#set: reversible reaction associated=RXN-2425|RXN0-2044}}
+
{{#set: smiles=C1(NC2(C(C(CC=O)=1)=CC(=CC=2)O))}}
 +
{{#set: inchi key=InChIKey=OBFAPCIUSYHFIE-UHFFFAOYSA-N}}
 +
{{#set: common name=5-hydroxyindole acetaldehyde}}
 +
{{#set: molecular weight=175.187   }}
 +
{{#set: consumed by=RXN-10780}}

Latest revision as of 19:53, 21 March 2018

Metabolite 5-HYDROXYINDOLE_ACETALDEHYDE

  • smiles:
    • C1(NC2(C(C(CC=O)=1)=CC(=CC=2)O))
  • inchi key:
    • InChIKey=OBFAPCIUSYHFIE-UHFFFAOYSA-N
  • common name:
    • 5-hydroxyindole acetaldehyde
  • molecular weight:
    • 175.187
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • HMDB : HMDB04073
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC50157



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