Difference between revisions of "HOP-2229-ENE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7630 CPD-7630] == * smiles: ** C3(=C(C2(OC1(=CC(=CC(=C1CC2O)O)O)))C=C(O)C(=C3)O) * inchi ke...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXY-N6N6N6-TRIMETHYL-L-LYSINE 3-HYDROXY-N6N6N6-TRIMETHYL-L-LYSINE] == * smiles: ** C[N+](...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-7630 CPD-7630] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXY-N6N6N6-TRIMETHYL-L-LYSINE 3-HYDROXY-N6N6N6-TRIMETHYL-L-LYSINE] ==
 
* smiles:
 
* smiles:
−
** C3(=C(C2(OC1(=CC(=CC(=C1CC2O)O)O)))C=C(O)C(=C3)O)
+
** C[N+](CCCC(C(C([O-])=O)[N+])O)(C)C
 
* inchi key:
 
* inchi key:
−
** InChIKey=PFTAWBLQPZVEMU-UKRRQHHQSA-N
+
** InChIKey=ZRJHLGYVUCPZNH-MQWKRIRWSA-O
 
* common name:
 
* common name:
−
** (-)-epicatechin
+
** 3-hydroxy-N6,N6,N6-trimethyl-L-lysine
 
* molecular weight:
 
* molecular weight:
−
** 290.272    
+
** 205.276    
 
* Synonym(s):
 
* Synonym(s):
−
** epicatechin
+
** (5-amino-5-carboxy-4-hydroxy-pentyl)-trimethyl-ammonium
−
** 2,3-cis-epicatechin
+
** 3-hydroxy-N6,N6,N6-trimethyl-L-lysin-N6-ium
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-9896]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-9725]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* LIPID_MAPS : LMPK12020003
 
−
* PUBCHEM:
 
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=72276 72276]
 
−
* HMDB : HMDB01871
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C09727 C09727]
+
** [http://www.genome.jp/dbget-bin/www_bget?C01259 C01259]
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.65230.html 65230]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=90 90]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57515 57515]
−
* METABOLIGHTS : MTBLC90
+
* METABOLIGHTS : MTBLC57515
−
{{#set: smiles=C3(=C(C2(OC1(=CC(=CC(=C1CC2O)O)O)))C=C(O)C(=C3)O)}}
+
* PUBCHEM:
−
{{#set: inchi key=InChIKey=PFTAWBLQPZVEMU-UKRRQHHQSA-N}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25203146 25203146]
−
{{#set: common name=(-)-epicatechin}}
+
* HMDB : HMDB01422
−
{{#set: molecular weight=290.272   }}
+
{{#set: smiles=C[N+](CCCC(C(C([O-])=O)[N+])O)(C)C}}
−
{{#set: common name=epicatechin|2,3-cis-epicatechin}}
+
{{#set: inchi key=InChIKey=ZRJHLGYVUCPZNH-MQWKRIRWSA-O}}
−
{{#set: produced by=RXN-9725}}
+
{{#set: common name=3-hydroxy-N6,N6,N6-trimethyl-L-lysine}}
 +
{{#set: molecular weight=205.276   }}
 +
{{#set: common name=(5-amino-5-carboxy-4-hydroxy-pentyl)-trimethyl-ammonium|3-hydroxy-N6,N6,N6-trimethyl-L-lysin-N6-ium}}
 +
{{#set: consumed by=RXN-9896}}

Revision as of 19:52, 18 March 2018

Metabolite 3-HYDROXY-N6N6N6-TRIMETHYL-L-LYSINE

  • smiles:
    • C[N+](CCCC(C(C([O-])=O)[N+])O)(C)C
  • inchi key:
    • InChIKey=ZRJHLGYVUCPZNH-MQWKRIRWSA-O
  • common name:
    • 3-hydroxy-N6,N6,N6-trimethyl-L-lysine
  • molecular weight:
    • 205.276
  • Synonym(s):
    • (5-amino-5-carboxy-4-hydroxy-pentyl)-trimethyl-ammonium
    • 3-hydroxy-N6,N6,N6-trimethyl-L-lysin-N6-ium

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC57515
  • PUBCHEM:
  • HMDB : HMDB01422
"C[N+](CCCC(C(C([O-])=O)[N+])O)(C)C" cannot be used as a page name in this wiki.



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