Difference between revisions of "CPD-11665"

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(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN 3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN] == * direction: ** L...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11665 CPD-11665] == * smiles: ** C(N)CC1(=CNC2(=C1C=C(OS(=O)(=O)O)C=C2)) * common name: **...")
 
(3 intermediate revisions by the same user not shown)
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[[Category:Reaction]]
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[[Category:Metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN 3-HYDROXYISOBUTYRATE-DEHYDROGENASE-RXN] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11665 CPD-11665] ==
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* direction:
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* smiles:
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** LEFT-TO-RIGHT
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** C(N)CC1(=CNC2(=C1C=C(OS(=O)(=O)O)C=C2))
 
* common name:
 
* common name:
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** 3-hydroxyisobutyrate_mitochondrial
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** serotonin O-sulfate
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** 3-hydroxyisobutyrate_dehydrogenase
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* inchi key:
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** uncharacterized_oxidoreductase
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** InChIKey=JFWYSGGSCOOBGK-UHFFFAOYSA-N
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* ec number:
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* molecular weight:
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** [http://enzyme.expasy.org/EC/1.1.1.31 EC-1.1.1.31]
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** 256.276   
 
* Synonym(s):
 
* Synonym(s):
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** 5-hydroxytryptamine O-sulfate
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** 3-(2-aminoethyl)-1H-indol-5-yl hydrogen sulfate
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** 1H-indol-5-ol, 3-(2-aminoethyl)-, hydrogen sulfate (ester)
  
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== Reaction Formula ==
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== Reaction(s) known to consume the compound ==
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* With identifiers:
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== Reaction(s) known to produce the compound ==
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** 1 [[NAD]][c] '''+''' 1 [[CPD-12175]][c] '''=>''' 1 [[NADH]][c] '''+''' 1 [[CH3-MALONATE-S-ALD]][c] '''+''' 1 [[PROTON]][c]
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* [[RXN-10777]]
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* With common name(s):
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== Reaction(s) of unknown directionality ==
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** 1 NAD+[c] '''+''' 1 (S)-3-hydroxy-isobutanoate[c] '''=>''' 1 NADH[c] '''+''' 1 (S)-methylmalonate-semialdehyde[c] '''+''' 1 H+[c]
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== Genes associated with this reaction  ==
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Genes have been associated with this reaction based on different elements listed below.
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* [[Tiso_gene_19590]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** [[pantograph]]-[[esiliculosus]]
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** [[pantograph]]-[[creinhardtii]]
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* [[Tiso_gene_5857]]
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** [[pantograph]]-[[athaliana]]
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** [[pantograph]]-[[creinhardtii]]
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* [[Tiso_gene_19771]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_7107]]
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** IN-SILICO_ANNOTATION
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***AUTOMATED-NAME-MATCH
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* [[Tiso_gene_19772]]
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** IN-SILICO_ANNOTATION
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***EC-NUMBER
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** EXPERIMENTAL_ANNOTATION
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***EC-NUMBER
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* [[Tiso_gene_19592]]
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** [[pantograph]]-[[esiliculosus]]
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** [[pantograph]]-[[creinhardtii]]
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== Pathways  ==
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* [[VALDEG-PWY]], L-valine degradation I: [http://metacyc.org/META/NEW-IMAGE?object=VALDEG-PWY VALDEG-PWY]
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** '''8''' reactions found over '''8''' reactions in the full pathway
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== Reconstruction information  ==
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* [[orthology]]:
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** [[pantograph]]:
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*** [[creinhardtii]]
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*** [[esiliculosus]]
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*** [[athaliana]]
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* [[annotation]]:
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** [[pathwaytools]]:
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*** [[experimental_annotation]]
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*** [[in-silico_annotation]]
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== External links  ==
 
== External links  ==
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* LIGAND-RXN:
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* PUBCHEM:
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** [http://www.genome.jp/dbget-bin/www_bget?R02047 R02047]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=152151 152151]
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* UNIPROT:
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* CHEMSPIDER:
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** [http://www.uniprot.org/uniprot/P29266 P29266]
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** [http://www.chemspider.com/Chemical-Structure.134104.html 134104]
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** [http://www.uniprot.org/uniprot/P28811 P28811]
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{{#set: smiles=C(N)CC1(=CNC2(=C1C=C(OS(=O)(=O)O)C=C2))}}
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** [http://www.uniprot.org/uniprot/Q8XAE4 Q8XAE4]
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{{#set: common name=serotonin O-sulfate}}
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** [http://www.uniprot.org/uniprot/Q55702 Q55702]
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{{#set: inchi key=InChIKey=JFWYSGGSCOOBGK-UHFFFAOYSA-N}}
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** [http://www.uniprot.org/uniprot/Q9XTI0 Q9XTI0]
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{{#set: molecular weight=256.276    }}
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{{#set: direction=LEFT-TO-RIGHT}}
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{{#set: common name=5-hydroxytryptamine O-sulfate|3-(2-aminoethyl)-1H-indol-5-yl hydrogen sulfate|1H-indol-5-ol, 3-(2-aminoethyl)-, hydrogen sulfate (ester)}}
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{{#set: common name=3-hydroxyisobutyrate_mitochondrial}}
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{{#set: produced by=RXN-10777}}
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{{#set: common name=3-hydroxyisobutyrate_dehydrogenase}}
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{{#set: common name=uncharacterized_oxidoreductase}}
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{{#set: ec number=EC-1.1.1.31}}
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{{#set: gene associated=Tiso_gene_19590|Tiso_gene_5857|Tiso_gene_19771|Tiso_gene_7107|Tiso_gene_19772|Tiso_gene_19592}}
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{{#set: in pathway=VALDEG-PWY}}
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{{#set: reconstruction category=orthology}}
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{{#set: reconstruction tool=pantograph}}
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{{#set: reconstruction source=creinhardtii|esiliculosus|athaliana}}
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{{#set: reconstruction category=annotation}}
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{{#set: reconstruction tool=pathwaytools}}
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{{#set: reconstruction source=experimental_annotation|in-silico_annotation}}
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Latest revision as of 20:21, 21 March 2018

Metabolite CPD-11665

  • smiles:
    • C(N)CC1(=CNC2(=C1C=C(OS(=O)(=O)O)C=C2))
  • common name:
    • serotonin O-sulfate
  • inchi key:
    • InChIKey=JFWYSGGSCOOBGK-UHFFFAOYSA-N
  • molecular weight:
    • 256.276
  • Synonym(s):
    • 5-hydroxytryptamine O-sulfate
    • 3-(2-aminoethyl)-1H-indol-5-yl hydrogen sulfate
    • 1H-indol-5-ol, 3-(2-aminoethyl)-, hydrogen sulfate (ester)

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links




Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=CPD-11665&oldid=48125"