Difference between revisions of "CPD1G-774"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=FERULOYL-COA FERULOYL-COA] == * smiles: ** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)C=CC1(C=C(OC)C(O)=CC...")
 
 
(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=FERULOYL-COA FERULOYL-COA] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-774 CPD1G-774] ==
 
* smiles:
 
* smiles:
** CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)C=CC1(C=C(OC)C(O)=CC=1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]
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** 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)
 +
* molecular weight:
 +
** 1668.519   
 
* inchi key:
 
* inchi key:
** InChIKey=GBXZVJQQDAJGSO-NBXNMEGSSA-J
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** InChIKey=WFTJPLICCFEYDD-UQWWGAJESA-L
 
* common name:
 
* common name:
** feruloyl-CoA
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** 6-O-trans-keto-mycolyl-trehalose 6-phosphate
* molecular weight:
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** 939.674   
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* Synonym(s):
 
* Synonym(s):
** trans-feruloyl-CoA
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-1106]]
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* [[RXN1G-1439]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[CAFFEOYL-COA-O-METHYLTRANSFERASE-RXN]]
 
* [[6.2.1.34-RXN]]
 
 
== 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=44229137 44229137]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658437 90658437]
* CHEBI:
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{{#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)}}
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57276 57276]
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{{#set: molecular weight=1668.519    }}
* LIGAND-CPD:
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{{#set: inchi key=InChIKey=WFTJPLICCFEYDD-UQWWGAJESA-L}}
** [http://www.genome.jp/dbget-bin/www_bget?C00406 C00406]
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{{#set: common name=6-O-trans-keto-mycolyl-trehalose 6-phosphate}}
{{#set: smiles=CC(C)(C(O)C(=O)NCCC(=O)NCCSC(=O)C=CC1(C=C(OC)C(O)=CC=1))COP(=O)(OP(=O)(OCC2(C(OP([O-])(=O)[O-])C(O)C(O2)N4(C3(=C(C(N)=NC=N3)N=C4))))[O-])[O-]}}
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{{#set: consumed by=RXN1G-1439}}
{{#set: inchi key=InChIKey=GBXZVJQQDAJGSO-NBXNMEGSSA-J}}
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{{#set: common name=feruloyl-CoA}}
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{{#set: molecular weight=939.674    }}
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{{#set: common name=trans-feruloyl-CoA}}
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{{#set: consumed by=RXN-1106}}
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{{#set: produced by=CAFFEOYL-COA-O-METHYLTRANSFERASE-RXN|6.2.1.34-RXN}}
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Latest revision as of 17:27, 9 January 2019

Metabolite CPD1G-774

  • 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)
  • molecular weight:
    • 1668.519
  • inchi key:
    • InChIKey=WFTJPLICCFEYDD-UQWWGAJESA-L
  • common name:
    • 6-O-trans-keto-mycolyl-trehalose 6-phosphate
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"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)" cannot be used as a page name in this wiki.