Difference between revisions of "3-INDOLYLGLYCOLALDEHYDE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11671 CPD-11671] == * smiles: ** C(O)CC1(=CNC2(=C1C=C(O)C=C2)) * common name: ** 5-hydroxyt...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-INDOLYLGLYCOLALDEHYDE 3-INDOLYLGLYCOLALDEHYDE] == * smiles: ** C2(=C(C1(C=CC=CC=1N2))C(O)C=O)...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11671 CPD-11671] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-INDOLYLGLYCOLALDEHYDE 3-INDOLYLGLYCOLALDEHYDE] ==
 
* smiles:
 
* smiles:
** C(O)CC1(=CNC2(=C1C=C(O)C=C2))
+
** C2(=C(C1(C=CC=CC=1N2))C(O)C=O)
 
* common name:
 
* common name:
** 5-hydroxytryptophol
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** indole-3-glycol aldehyde
 
* inchi key:
 
* inchi key:
** InChIKey=KQROHCSYOGBQGJ-UHFFFAOYSA-N
+
** InChIKey=XKZDNWMDLGQXML-UHFFFAOYSA-N
 
* molecular weight:
 
* molecular weight:
** 177.202    
+
** 175.187    
 
* Synonym(s):
 
* Synonym(s):
** hydroxytryptophol
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** 2-hydroxy-2-(1H-indol-3-yl)acetaldehyde
** 5-hydroxyindole-3-ethanol
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** 3-indoleglycol aldehyde
** 5-hydroxy-1H-indole-3-ethanol
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** 1H-indole-3-ethanol, 5-hydroxy-
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** indole-3-ethanol, 5-hydroxy-
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-10784]]
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* [[RXN-5424]]
* [[RXN-10782]]
+
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-10781]]
 
 
== 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=9061 9061]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=439951 439951]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.8708.html 8708]
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** [http://www.chemspider.com/Chemical-Structure.388979.html 388979]
* HMDB : HMDB01855
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* CHEBI:
{{#set: smiles=C(O)CC1(=CNC2(=C1C=C(O)C=C2))}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15976 15976]
{{#set: common name=5-hydroxytryptophol}}
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* LIGAND-CPD:
{{#set: inchi key=InChIKey=KQROHCSYOGBQGJ-UHFFFAOYSA-N}}
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** [http://www.genome.jp/dbget-bin/www_bget?C03230 C03230]
{{#set: molecular weight=177.202   }}
+
{{#set: smiles=C2(=C(C1(C=CC=CC=1N2))C(O)C=O)}}
{{#set: common name=hydroxytryptophol|5-hydroxyindole-3-ethanol|5-hydroxy-1H-indole-3-ethanol|1H-indole-3-ethanol, 5-hydroxy-|indole-3-ethanol, 5-hydroxy-}}
+
{{#set: common name=indole-3-glycol aldehyde}}
{{#set: consumed by=RXN-10784|RXN-10782}}
+
{{#set: inchi key=InChIKey=XKZDNWMDLGQXML-UHFFFAOYSA-N}}
{{#set: produced by=RXN-10781}}
+
{{#set: molecular weight=175.187   }}
 +
{{#set: common name=2-hydroxy-2-(1H-indol-3-yl)acetaldehyde|3-indoleglycol aldehyde}}
 +
{{#set: consumed by=RXN-5424}}

Latest revision as of 21:07, 21 March 2018

Metabolite 3-INDOLYLGLYCOLALDEHYDE

  • smiles:
    • C2(=C(C1(C=CC=CC=1N2))C(O)C=O)
  • common name:
    • indole-3-glycol aldehyde
  • inchi key:
    • InChIKey=XKZDNWMDLGQXML-UHFFFAOYSA-N
  • molecular weight:
    • 175.187
  • Synonym(s):
    • 2-hydroxy-2-(1H-indol-3-yl)acetaldehyde
    • 3-indoleglycol aldehyde

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links