Difference between revisions of "Tiso gene 2786"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BIOTIN BIOTIN] == * smiles: ** C1(SC(CCCCC(=O)[O-])[CH]2(NC(=O)N[CH]12)) * inchi key: ** InChIK...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPDQT-30 CPDQT-30] == * smiles: ** CSCCCCCCCC(=O)C([O-])=O * inchi key: ** InChIKey=MJGXIOUQXYX...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=BIOTIN BIOTIN] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPDQT-30 CPDQT-30] ==
 
* smiles:
 
* smiles:
−
** C1(SC(CCCCC(=O)[O-])[CH]2(NC(=O)N[CH]12))
+
** CSCCCCCCCC(=O)C([O-])=O
 
* inchi key:
 
* inchi key:
−
** InChIKey=YBJHBAHKTGYVGT-ZKWXMUAHSA-M
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** InChIKey=MJGXIOUQXYXGLP-UHFFFAOYSA-M
 
* common name:
 
* common name:
−
** biotin
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** 9-(methylthio)-2-oxononanoate
 
* molecular weight:
 
* molecular weight:
−
** 243.3    
+
** 217.302    
 
* Synonym(s):
 
* Synonym(s):
−
** vitamin H
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** 9-(methylthio)-2-oxononanoic acid
−
** coenzyme R
+
−
** d-biotin
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[6.3.4.11-RXN]]
 
−
* [[RXN0-7192]]
 
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* [[6.3.4.10-RXN]]
 
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* [[6.3.4.9-RXN]]
 
−
* [[BIOTINLIG-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[2.8.1.6-RXN]]
+
* [[RXN-18203]]
−
* [[RXN-17473]]
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* [[RXNQT-4174]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* CAS : 58-85-5
 
−
* METABOLIGHTS : MTBLC57586
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6560210 6560210]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44237169 44237169]
−
* HMDB : HMDB00030
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* KNAPSACK : C00007654
−
* LIGAND-CPD:
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{{#set: smiles=CSCCCCCCCC(=O)C([O-])=O}}
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** [http://www.genome.jp/dbget-bin/www_bget?C00120 C00120]
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{{#set: inchi key=InChIKey=MJGXIOUQXYXGLP-UHFFFAOYSA-M}}
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* CHEMSPIDER:
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{{#set: common name=9-(methylthio)-2-oxononanoate}}
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** [http://www.chemspider.com/Chemical-Structure.5028036.html 5028036]
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{{#set: molecular weight=217.302   }}
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* CHEBI:
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{{#set: common name=9-(methylthio)-2-oxononanoic acid}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57586 57586]
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{{#set: produced by=RXN-18203|RXNQT-4174}}
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* BIGG : btn
+
−
{{#set: smiles=C1(SC(CCCCC(=O)[O-])[CH]2(NC(=O)N[CH]12))}}
+
−
{{#set: inchi key=InChIKey=YBJHBAHKTGYVGT-ZKWXMUAHSA-M}}
+
−
{{#set: common name=biotin}}
+
−
{{#set: molecular weight=243.3   }}
+
−
{{#set: common name=vitamin H|coenzyme R|d-biotin}}
+
−
{{#set: consumed by=6.3.4.11-RXN|RXN0-7192|6.3.4.10-RXN|6.3.4.9-RXN|BIOTINLIG-RXN}}
+
−
{{#set: produced by=2.8.1.6-RXN|RXN-17473}}
+

Revision as of 18:54, 18 March 2018

Metabolite CPDQT-30

  • smiles:
    • CSCCCCCCCC(=O)C([O-])=O
  • inchi key:
    • InChIKey=MJGXIOUQXYXGLP-UHFFFAOYSA-M
  • common name:
    • 9-(methylthio)-2-oxononanoate
  • molecular weight:
    • 217.302
  • Synonym(s):
    • 9-(methylthio)-2-oxononanoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • PUBCHEM:
  • KNAPSACK : C00007654
"CSCCCCCCCC(=O)C([O-])=O" cannot be used as a page name in this wiki.



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