Difference between revisions of "CPD1G-774"

From metabolic_network
Jump to: navigation, search
(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...")
 
(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(...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=FERULOYL-COA FERULOYL-COA] ==
+
== 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-]
+
** 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)
 
* inchi key:
 
* inchi key:
−
** InChIKey=GBXZVJQQDAJGSO-NBXNMEGSSA-J
+
** InChIKey=WFTJPLICCFEYDD-UQWWGAJESA-L
 
* common name:
 
* common name:
−
** feruloyl-CoA
+
** 6-O-trans-keto-mycolyl-trehalose 6-phosphate
 
* molecular weight:
 
* molecular weight:
−
** 939.674    
+
** 1668.519    
 
* Synonym(s):
 
* Synonym(s):
−
** trans-feruloyl-CoA
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-1106]]
+
* [[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]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90658437 90658437]
−
* CHEBI:
+
{{#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]
+
{{#set: inchi key=InChIKey=WFTJPLICCFEYDD-UQWWGAJESA-L}}
−
* LIGAND-CPD:
+
{{#set: common name=6-O-trans-keto-mycolyl-trehalose 6-phosphate}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C00406 C00406]
+
{{#set: molecular weight=1668.519   }}
−
{{#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-]}}
+
{{#set: consumed by=RXN1G-1439}}
−
{{#set: inchi key=InChIKey=GBXZVJQQDAJGSO-NBXNMEGSSA-J}}
+
−
{{#set: common name=feruloyl-CoA}}
+
−
{{#set: molecular weight=939.674   }}
+
−
{{#set: common name=trans-feruloyl-CoA}}
+
−
{{#set: consumed by=RXN-1106}}
+
−
{{#set: produced by=CAFFEOYL-COA-O-METHYLTRANSFERASE-RXN|6.2.1.34-RXN}}
+

Revision as of 16:34, 23 May 2018

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



Retrieved from "http://gem-aureme.irisa.fr/ccrgem/index.php?title=CPD1G-774&oldid=17512"