Difference between revisions of "RXN1G-509"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11740 CPD-11740] == * smiles: ** C(P(C([O-])=O)([O-])=O)C(=O)C(=O)[O-] * inchi key: ** InCh...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10411 CPD-10411] == * smiles: ** C1(C(O)=C(O)C(O)=CC=1C2(OC3(C(CC(O)2)=C(O)C=C(O)C=3))) * i...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-11740 CPD-11740] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10411 CPD-10411] ==
 
* smiles:
 
* smiles:
** C(P(C([O-])=O)([O-])=O)C(=O)C(=O)[O-]
+
** C1(C(O)=C(O)C(O)=CC=1C2(OC3(C(CC(O)2)=C(O)C=C(O)C=3)))
 
* inchi key:
 
* inchi key:
** InChIKey=YTKWPNBYPYOWCP-UHFFFAOYSA-K
+
** InChIKey=XMOCLSLCDHWDHP-IUODEOHRSA-N
 
* common name:
 
* common name:
** carboxyphosphinopyruvate
+
** (-)-epigallocatechin
 
* molecular weight:
 
* molecular weight:
** 193.029    
+
** 306.271    
 
* Synonym(s):
 
* Synonym(s):
 +
** 2,3-cis-epigallocatechin
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-10828]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-10827]]
+
* [[RXN-9723]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* LIPID_MAPS : LMPK12020004
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45479707 45479707]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=72277 72277]
{{#set: smiles=C(P(C([O-])=O)([O-])=O)C(=O)C(=O)[O-]}}
+
* HMDB : HMDB38361
{{#set: inchi key=InChIKey=YTKWPNBYPYOWCP-UHFFFAOYSA-K}}
+
* LIGAND-CPD:
{{#set: common name=carboxyphosphinopyruvate}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C12136 C12136]
{{#set: molecular weight=193.029   }}
+
* CHEMSPIDER:
{{#set: consumed by=RXN-10828}}
+
** [http://www.chemspider.com/Chemical-Structure.65231.html 65231]
{{#set: produced by=RXN-10827}}
+
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=42255 42255]
 +
* METABOLIGHTS : MTBLC42255
 +
{{#set: smiles=C1(C(O)=C(O)C(O)=CC=1C2(OC3(C(CC(O)2)=C(O)C=C(O)C=3)))}}
 +
{{#set: inchi key=InChIKey=XMOCLSLCDHWDHP-IUODEOHRSA-N}}
 +
{{#set: common name=(-)-epigallocatechin}}
 +
{{#set: molecular weight=306.271   }}
 +
{{#set: common name=2,3-cis-epigallocatechin}}
 +
{{#set: produced by=RXN-9723}}

Revision as of 18:10, 10 January 2018

Metabolite CPD-10411

  • smiles:
    • C1(C(O)=C(O)C(O)=CC=1C2(OC3(C(CC(O)2)=C(O)C=C(O)C=3)))
  • inchi key:
    • InChIKey=XMOCLSLCDHWDHP-IUODEOHRSA-N
  • common name:
    • (-)-epigallocatechin
  • molecular weight:
    • 306.271
  • Synonym(s):
    • 2,3-cis-epigallocatechin

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIPID_MAPS : LMPK12020004
  • PUBCHEM:
  • HMDB : HMDB38361
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC42255