Difference between revisions of "CPD-3061"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=biomass_rxn biomass_rxn] == * direction: ** LEFT-TO-RIGHT * Synonym(s): == Reaction Formula == * W...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3061 CPD-3061] == * smiles: ** C1(C=C(C=CC=1C3(OC2(=CC(=CC=C2C(C3)=O)O)))O) * inchi key: **...")
 
(One intermediate revision by the same user not shown)
Line 1: Line 1:
−
[[Category:Reaction]]
+
[[Category:Metabolite]]
−
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=biomass_rxn biomass_rxn] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3061 CPD-3061] ==
−
* direction:
+
* smiles:
−
** LEFT-TO-RIGHT
+
** C1(C=C(C=CC=1C3(OC2(=CC(=CC=C2C(C3)=O)O)))O)
 +
* inchi key:
 +
** InChIKey=FURUXTVZLHCCNA-AWEZNQCLSA-N
 +
* common name:
 +
** (2S)-liquiritigenin
 +
* molecular weight:
 +
** 256.257   
 
* Synonym(s):
 
* Synonym(s):
 +
** 4',7-dihydroxyflavanone
  
−
== Reaction Formula ==
+
== Reaction(s) known to consume the compound ==
−
* With identifiers:
+
== Reaction(s) known to produce the compound ==
−
** 12.5 [[L-ASPARTATE]][c] '''+''' 18.85 [[GLT]][c] '''+''' 0.1 [[HIS]][c] '''+''' 0.1 [[L-ORNITHINE]][c] '''+''' 1.35 [[PRO]][c] '''+''' 0.65 [[THR]][c] '''+''' 0.123 [[GLYCERATE]][c] '''+''' 2.375 [[GLYCEROL]][c] '''+''' 0.029 [[GLYCOLLATE]][c] '''+''' 0.2 [[ILE]][c] '''+''' 0.3 [[LEU]][c] '''+''' 0.35 [[LYS]][c] '''+''' 3.35 [[SER]][c] '''+''' 9.37 [[THREO-DS-ISO-CITRATE]][c] '''+''' 331.4 [[MANNITOL]][c] '''+''' 0.01 [[4-AMINO-BUTYRATE]][c] '''+''' 0.3 [[CYS]][c] '''+''' 0.1 [[ARG]][c] '''+''' 0.3 [[MET]][c] '''+''' 0.75 [[ASN]][c] '''+''' 19.3055 [[CIT]][c] '''+''' 2.7615 [[GLC]][c] '''+''' 10.7 [[GLN]][c] '''+''' 3.8 [[GLY]][c] '''+''' 26.6 [[L-ALPHA-ALANINE]][c] '''+''' 0.125 [[TYR]][c] '''+''' 0.35 [[PHE]][c] '''+''' 0.878 [[SUC]][c] '''+''' 0.115 [[TRP]][c] '''+''' 0.85 [[VAL]][c] '''=>''' 1 [[BIOMASS]][c]
+
* [[RXN-3221]]
−
* With common name(s):
+
== Reaction(s) of unknown directionality ==
−
**
+
−
== Genes associated with this reaction  ==
+
−
Genes have been associated with this reaction based on different elements listed below.
+
−
* [[None]]
+
−
** 2_biomass_rxn
+
−
== Pathways  ==
+
−
== Reconstruction information  ==
+
−
* Category: [[manual]]
+
−
** Source: [[manual-2_biomass_rxn]]
+
−
*** Comment: [[forfba]]
+
 
== External links  ==
 
== External links  ==
−
{{#set: direction=LEFT-TO-RIGHT}}
+
* DRUGBANK : DB03601
−
{{#set: gene associated=None}}
+
* PUBCHEM:
−
{{#set: in pathway=}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=114829 114829]
−
{{#set: reconstruction category=manual}}
+
* HMDB : HMDB29519
−
{{#set: reconstruction source=manual-2_biomass_rxn}}
+
* LIGAND-CPD:
−
{{#set: reconstruction comment=forfba}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C09762 C09762]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.102790.html 102790]
 +
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28777 28777]
 +
* METABOLIGHTS : MTBLC28777
 +
{{#set: smiles=C1(C=C(C=CC=1C3(OC2(=CC(=CC=C2C(C3)=O)O)))O)}}
 +
{{#set: inchi key=InChIKey=FURUXTVZLHCCNA-AWEZNQCLSA-N}}
 +
{{#set: common name=(2S)-liquiritigenin}}
 +
{{#set: molecular weight=256.257    }}
 +
{{#set: common name=4',7-dihydroxyflavanone}}
 +
{{#set: produced by=RXN-3221}}

Latest revision as of 19:11, 21 March 2018

Metabolite CPD-3061

  • smiles:
    • C1(C=C(C=CC=1C3(OC2(=CC(=CC=C2C(C3)=O)O)))O)
  • inchi key:
    • InChIKey=FURUXTVZLHCCNA-AWEZNQCLSA-N
  • common name:
    • (2S)-liquiritigenin
  • molecular weight:
    • 256.257
  • Synonym(s):
    • 4',7-dihydroxyflavanone

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • DRUGBANK : DB03601
  • PUBCHEM:
  • HMDB : HMDB29519
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC28777




Retrieved from "http://gem-aureme.irisa.fr/ectogem/index.php?title=CPD-3061&oldid=25136"