Difference between revisions of "CPD1G-771"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2K-ADIPATE 2K-ADIPATE] == * smiles: ** C(CC(=O)C(=O)[O-])CC(=O)[O-] * inchi key: ** InChIKey=FG...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-771 CPD1G-771] == * smiles: ** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(...")
 
(2 intermediate revisions by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2K-ADIPATE 2K-ADIPATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-771 CPD1G-771] ==
 
* smiles:
 
* smiles:
−
** C(CC(=O)C(=O)[O-])CC(=O)[O-]
+
** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)
−
* inchi key:
+
−
** InChIKey=FGSBNBBHOZHUBO-UHFFFAOYSA-L
+
 
* common name:
 
* common name:
−
** 2-oxoadipate
+
** 6-O-cis-methoxy-mycolyl-trehalose 6-phosphate
 +
* inchi key:
 +
** InChIKey=NYSGJFYKJQFMRN-ZVNWTMLTSA-L
 
* molecular weight:
 
* molecular weight:
−
** 158.11    
+
** 1656.508    
 
* Synonym(s):
 
* Synonym(s):
−
** 2-ketoadipate
 
−
** α-ketoadipate
 
−
** 2-keto-adipate
 
−
** 2-oxohexanedionic acid
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[2-KETO-ADIPATE-DEHYDROG-RXN]]
+
* [[RXN1G-1436]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[2-AMINOADIPATE-AMINOTRANSFERASE-RXN]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 3184-35-8
 
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=23615192 23615192]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657776 90657776]
−
* HMDB : HMDB00225
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{{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)}}
−
* LIGAND-CPD:
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{{#set: common name=6-O-cis-methoxy-mycolyl-trehalose 6-phosphate}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C00322 C00322]
+
{{#set: inchi key=InChIKey=NYSGJFYKJQFMRN-ZVNWTMLTSA-L}}
−
* CHEMSPIDER:
+
{{#set: molecular weight=1656.508   }}
−
** [http://www.chemspider.com/Chemical-Structure.19951093.html 19951093]
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{{#set: consumed by=RXN1G-1436}}
−
* CHEBI:
+
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57499 57499]
+
−
* METABOLIGHTS : MTBLC57499
+
−
{{#set: smiles=C(CC(=O)C(=O)[O-])CC(=O)[O-]}}
+
−
{{#set: inchi key=InChIKey=FGSBNBBHOZHUBO-UHFFFAOYSA-L}}
+
−
{{#set: common name=2-oxoadipate}}
+
−
{{#set: molecular weight=158.11   }}
+
−
{{#set: common name=2-ketoadipate|α-ketoadipate|2-keto-adipate|2-oxohexanedionic acid}}
+
−
{{#set: consumed by=2-KETO-ADIPATE-DEHYDROG-RXN}}
+
−
{{#set: consumed or produced by=2-AMINOADIPATE-AMINOTRANSFERASE-RXN}}
+

Latest revision as of 19:12, 21 March 2018

Metabolite CPD1G-771

  • smiles:
    • CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)
  • common name:
    • 6-O-cis-methoxy-mycolyl-trehalose 6-phosphate
  • inchi key:
    • InChIKey=NYSGJFYKJQFMRN-ZVNWTMLTSA-L
  • molecular weight:
    • 1656.508
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)" cannot be used as a page name in this wiki.



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