Difference between revisions of "CPD-7424"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7100 CPD-7100] == * smiles: ** CC(C(C(=O)[O-])C(=O)C(=O)[O-])C * common name: ** (2S)-2-iso...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7424 CPD-7424] == * smiles: ** CC(C=CC=C(C)[CH]=C=C1(C(O)(C)CC(O)CC(C)(C)1))=CC=CC=C(C)C=CC...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7100 CPD-7100] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7424 CPD-7424] ==
 
* smiles:
 
* smiles:
−
** CC(C(C(=O)[O-])C(=O)C(=O)[O-])C
+
** CC(C=CC=C(C)[CH]=C=C1(C(O)(C)CC(O)CC(C)(C)1))=CC=CC=C(C)C=CC=C(C)C=CC23(C(C)(C)CC(O)CC(C)(O2)3)
 
* common name:
 
* common name:
−
** (2S)-2-isopropyl-3-oxosuccinate
+
** 9'-cis-neoxanthin
 
* inchi key:
 
* inchi key:
−
** InChIKey=HIIZAGQWABAMRR-BYPYZUCNSA-L
+
** InChIKey=PGYAYSRVSAJXTE-OQASCVKESA-N
 
* molecular weight:
 
* molecular weight:
−
** 172.137    
+
** 600.88    
 
* Synonym(s):
 
* Synonym(s):
−
** 2-isopropyl-3-oxosuccinate
+
** 9cNeox
 +
** 9c-neoxanthin
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-7800]]
+
* [[RXN-698]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[IMDH]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[3-ISOPROPYLMALDEHYDROG-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* LIGAND-CPD:
 
−
** [http://www.genome.jp/dbget-bin/www_bget?C04236 C04236]
 
−
* HMDB : HMDB12149
 
−
* CHEBI:
 
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17214 17214]
 
−
* BIGG : 3c4mop
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=6419705 6419705]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5282217 5282217]
−
{{#set: smiles=CC(C(C(=O)[O-])C(=O)C(=O)[O-])C}}
+
* CHEMSPIDER:
−
{{#set: common name=(2S)-2-isopropyl-3-oxosuccinate}}
+
** [http://www.chemspider.com/Chemical-Structure.10392237.html 10392237]
−
{{#set: inchi key=InChIKey=HIIZAGQWABAMRR-BYPYZUCNSA-L}}
+
* CHEBI:
−
{{#set: molecular weight=172.137   }}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=35306 35306]
−
{{#set: common name=2-isopropyl-3-oxosuccinate}}
+
* LIGAND-CPD:
−
{{#set: consumed by=RXN-7800}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C13431 C13431]
−
{{#set: produced by=IMDH}}
+
{{#set: smiles=CC(C=CC=C(C)[CH]=C=C1(C(O)(C)CC(O)CC(C)(C)1))=CC=CC=C(C)C=CC=C(C)C=CC23(C(C)(C)CC(O)CC(C)(O2)3)}}
−
{{#set: reversible reaction associated=3-ISOPROPYLMALDEHYDROG-RXN}}
+
{{#set: common name=9'-cis-neoxanthin}}
 +
{{#set: inchi key=InChIKey=PGYAYSRVSAJXTE-OQASCVKESA-N}}
 +
{{#set: molecular weight=600.88   }}
 +
{{#set: common name=9cNeox|9c-neoxanthin}}
 +
{{#set: consumed by=RXN-698}}

Latest revision as of 21:19, 21 March 2018

Metabolite CPD-7424

  • smiles:
    • CC(C=CC=C(C)[CH]=C=C1(C(O)(C)CC(O)CC(C)(C)1))=CC=CC=C(C)C=CC=C(C)C=CC23(C(C)(C)CC(O)CC(C)(O2)3)
  • common name:
    • 9'-cis-neoxanthin
  • inchi key:
    • InChIKey=PGYAYSRVSAJXTE-OQASCVKESA-N
  • molecular weight:
    • 600.88
  • Synonym(s):
    • 9cNeox
    • 9c-neoxanthin

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C=CC=C(C)[CH]=C=C1(C(O)(C)CC(O)CC(C)(C)1))=CC=CC=C(C)C=CC=C(C)C=CC23(C(C)(C)CC(O)CC(C)(O2)3)" cannot be used as a page name in this wiki.



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