Difference between revisions of "CPD-1130"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-774 CPD1G-774] == * smiles: ** CCCCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)OCC2(C(O)C(O)C(O)C(OC1(C(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-1130 CPD-1130] == * smiles: ** CCC(C(=O)[O-])C(C([O-])=O)O * inchi key: ** InChIKey=JUCRENB...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-774 CPD1G-774] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-1130 CPD-1130] ==
 
* smiles:
 
* smiles:
** CCCCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)OCC2(C(O)C(O)C(O)C(OC1(C(O)C(O)C(O)C(COP(=O)([O-])[O-])O1))O2))C(O)CCCCCCCCCCCCCCCCC3(CC3C(C)CCCCCCCCCCCCCCCCC(=O)C(C)CCCCCCCCCCCCCCCCC)
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** CCC(C(=O)[O-])C(C([O-])=O)O
 
* inchi key:
 
* inchi key:
** InChIKey=WFTJPLICCFEYDD-UQWWGAJESA-L
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** InChIKey=JUCRENBZZQKFGK-UHFFFAOYSA-L
 
* common name:
 
* common name:
** 6-O-trans-keto-mycolyl-trehalose 6-phosphate
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** 3-ethylmalate
 
* molecular weight:
 
* molecular weight:
** 1668.519    
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** 160.126    
 
* Synonym(s):
 
* Synonym(s):
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN1G-1439]]
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* [[RXN-14986]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658437 90658437]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=21145023 21145023]
{{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCCCC(C(=O)OCC2(C(O)C(O)C(O)C(OC1(C(O)C(O)C(O)C(COP(=O)([O-])[O-])O1))O2))C(O)CCCCCCCCCCCCCCCCC3(CC3C(C)CCCCCCCCCCCCCCCCC(=O)C(C)CCCCCCCCCCCCCCCCC)}}
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* CHEMSPIDER:
{{#set: inchi key=InChIKey=WFTJPLICCFEYDD-UQWWGAJESA-L}}
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** [http://www.chemspider.com/Chemical-Structure.20015785.html 20015785]
{{#set: common name=6-O-trans-keto-mycolyl-trehalose 6-phosphate}}
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* CHEBI:
{{#set: molecular weight=1668.519   }}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57425 57425]
{{#set: consumed by=RXN1G-1439}}
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* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C01989 C01989]
 +
{{#set: smiles=CCC(C(=O)[O-])C(C([O-])=O)O}}
 +
{{#set: inchi key=InChIKey=JUCRENBZZQKFGK-UHFFFAOYSA-L}}
 +
{{#set: common name=3-ethylmalate}}
 +
{{#set: molecular weight=160.126   }}
 +
{{#set: consumed by=RXN-14986}}

Latest revision as of 19:42, 21 March 2018

Metabolite CPD-1130

  • smiles:
    • CCC(C(=O)[O-])C(C([O-])=O)O
  • inchi key:
    • InChIKey=JUCRENBZZQKFGK-UHFFFAOYSA-L
  • common name:
    • 3-ethylmalate
  • molecular weight:
    • 160.126
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCC(C(=O)[O-])C(C([O-])=O)O" cannot be used as a page name in this wiki.