Difference between revisions of "CPD-12932"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=25-DIDEHYDRO-D-GLUCONATE 25-DIDEHYDRO-D-GLUCONATE] == * smiles: ** C(C(C(C(C(C([O-])=O)=O)O)O)=...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12932 CPD-12932] == * smiles: ** CC(C)=CC=CC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C...")
 
(One intermediate revision by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=25-DIDEHYDRO-D-GLUCONATE 25-DIDEHYDRO-D-GLUCONATE] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-12932 CPD-12932] ==
 
* smiles:
 
* smiles:
** C(C(C(C(C(C([O-])=O)=O)O)O)=O)O
+
** CC(C)=CC=CC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C
* inchi key:
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** InChIKey=RXMWXENJQAINCC-DMTCNVIQSA-M
+
 
* common name:
 
* common name:
** 2,5-didehydro-D-gluconate
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** all-trans-3,4-didehydrolycopene
 +
* inchi key:
 +
** InChIKey=OCMSUPSDVXKDFY-FQMRBFJQSA-N
 
* molecular weight:
 
* molecular weight:
** 191.117    
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** 534.867    
 
* Synonym(s):
 
* Synonym(s):
** 2,5-diketo-D-gluconate
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** 3,4-dehydrolycopene
** 2,5-diketogluconic acid
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** 3,4-didehydrolycopene
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-11999]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[1.1.1.274-RXN]]
 
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=9548631 9548631]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=16061227 16061227]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.7827554.html 7827554]
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** [http://www.chemspider.com/Chemical-Structure.17220904.html 17220904]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=11449 11449]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62474 62474]
* BIGG : 25dkglcn
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C02780 C02780]
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** [http://www.genome.jp/dbget-bin/www_bget?C15867 C15867]
{{#set: smiles=C(C(C(C(C(C([O-])=O)=O)O)O)=O)O}}
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{{#set: smiles=CC(C)=CC=CC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C}}
{{#set: inchi key=InChIKey=RXMWXENJQAINCC-DMTCNVIQSA-M}}
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{{#set: common name=all-trans-3,4-didehydrolycopene}}
{{#set: common name=2,5-didehydro-D-gluconate}}
+
{{#set: inchi key=InChIKey=OCMSUPSDVXKDFY-FQMRBFJQSA-N}}
{{#set: molecular weight=191.117   }}
+
{{#set: molecular weight=534.867   }}
{{#set: common name=2,5-diketo-D-gluconate|2,5-diketogluconic acid}}
+
{{#set: common name=3,4-dehydrolycopene|3,4-didehydrolycopene}}
{{#set: reversible reaction associated=1.1.1.274-RXN}}
+
{{#set: consumed by=RXN-11999}}

Latest revision as of 21:14, 21 March 2018

Metabolite CPD-12932

  • smiles:
    • CC(C)=CC=CC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C
  • common name:
    • all-trans-3,4-didehydrolycopene
  • inchi key:
    • InChIKey=OCMSUPSDVXKDFY-FQMRBFJQSA-N
  • molecular weight:
    • 534.867
  • Synonym(s):
    • 3,4-dehydrolycopene
    • 3,4-didehydrolycopene

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links