Difference between revisions of "Tiso gene 9303"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-637 CPD-637] == * smiles: ** CC1(C(=C(C=CC=1)O)C([O-])=O) * inchi key: ** InChIKey=HCJMNOSI...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-130 CPD1F-130] == * smiles: ** CC(C=CC=C(C=CC1(C(C)(C)CC(CC=1C)O))C)=CC=CC=C(C=CC=C(C=CC2...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-637 CPD-637] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-130 CPD1F-130] ==
 
* smiles:
 
* smiles:
−
** CC1(C(=C(C=CC=1)O)C([O-])=O)
+
** CC(C=CC=C(C=CC1(C(C)(C)CC(CC=1C)O))C)=CC=CC=C(C=CC=C(C=CC2(=C(CC(CC(C)(C)2)O)C))C)C
 
* inchi key:
 
* inchi key:
−
** InChIKey=HCJMNOSIAGSZBM-UHFFFAOYSA-M
+
** InChIKey=JKQXZKUSFCKOGQ-QAYBQHTQSA-N
 
* common name:
 
* common name:
−
** 6-methylsalicylate
+
** zeaxanthin
 
* molecular weight:
 
* molecular weight:
−
** 151.141    
+
** 568.881    
 
* Synonym(s):
 
* Synonym(s):
−
** Methylsalicylic acid
+
** β,β-carotene-3,3'-diol
−
** 6-Methyl 2-hydroxybenzenecarboxylate
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-7978]]
 +
* [[RXN-13193]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[2.3.1.165-RXN]]
+
* [[RXN-7985]]
 +
* [[RXN-8026]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-13185]]
 
== External links  ==
 
== External links  ==
 +
* LIPID_MAPS : LMPR01070261
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54693536 54693536]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280899 5280899]
 +
* HMDB : HMDB02789
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C06098 C06098]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.5342108.html 5342108]
+
** [http://www.chemspider.com/Chemical-Structure.4444421.html 4444421]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=36658 36658]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=27547 27547]
−
* LIGAND-CPD:
+
* METABOLIGHTS : MTBLC27547
−
** [http://www.genome.jp/dbget-bin/www_bget?C02657 C02657]
+
{{#set: smiles=CC(C=CC=C(C=CC1(C(C)(C)CC(CC=1C)O))C)=CC=CC=C(C=CC=C(C=CC2(=C(CC(CC(C)(C)2)O)C))C)C}}
−
{{#set: smiles=CC1(C(=C(C=CC=1)O)C([O-])=O)}}
+
{{#set: inchi key=InChIKey=JKQXZKUSFCKOGQ-QAYBQHTQSA-N}}
−
{{#set: inchi key=InChIKey=HCJMNOSIAGSZBM-UHFFFAOYSA-M}}
+
{{#set: common name=zeaxanthin}}
−
{{#set: common name=6-methylsalicylate}}
+
{{#set: molecular weight=568.881   }}
−
{{#set: molecular weight=151.141   }}
+
{{#set: common name=β,β-carotene-3,3'-diol}}
−
{{#set: common name=Methylsalicylic acid|6-Methyl 2-hydroxybenzenecarboxylate}}
+
{{#set: consumed by=RXN-7978|RXN-13193}}
−
{{#set: produced by=2.3.1.165-RXN}}
+
{{#set: produced by=RXN-7985|RXN-8026}}
 +
{{#set: reversible reaction associated=RXN-13185}}

Revision as of 19:55, 18 March 2018

Metabolite CPD1F-130

  • smiles:
    • CC(C=CC=C(C=CC1(C(C)(C)CC(CC=1C)O))C)=CC=CC=C(C=CC=C(C=CC2(=C(CC(CC(C)(C)2)O)C))C)C
  • inchi key:
    • InChIKey=JKQXZKUSFCKOGQ-QAYBQHTQSA-N
  • common name:
    • zeaxanthin
  • molecular weight:
    • 568.881
  • Synonym(s):
    • β,β-carotene-3,3'-diol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIPID_MAPS : LMPR01070261
  • PUBCHEM:
  • HMDB : HMDB02789
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC27547





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