Difference between revisions of "APIGENIN"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6994 CPD-6994] == * smiles: ** C3(C(C2(OC1(C=C(C=C(C=1C(C2)=O)O)[O-])))=CC(=C(C=3)O)O) * in...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=APIGENIN APIGENIN] == * smiles: ** C2(C(C=CC(C1(C(=CC(=CC(O)=1)O)O))=O)=CC=C(C=2)O) * inchi key...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6994 CPD-6994] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=APIGENIN APIGENIN] ==
 
* smiles:
 
* smiles:
** C3(C(C2(OC1(C=C(C=C(C=1C(C2)=O)O)[O-])))=CC(=C(C=3)O)O)
+
** C2(C(C=CC(C1(C(=CC(=CC(O)=1)O)O))=O)=CC=C(C=2)O)
 
* inchi key:
 
* inchi key:
** InChIKey=SBHXYTNGIZCORC-ZDUSSCGKSA-M
+
** InChIKey=YQHMWTPYORBCMF-ZZXKWVIFSA-N
 
* common name:
 
* common name:
** (2S)-eriodictyol
+
** 2',4,4',6'-tetrahydroxychalcone
 
* molecular weight:
 
* molecular weight:
** 287.248    
+
** 272.257    
 
* Synonym(s):
 
* Synonym(s):
 +
** naringenin chalcone
 +
** chalconaringenin
 +
** 2'4'6'4-Tetrahydroxychalcone
 +
** Isosalipurpol
 +
** tetrahydroxychalcone
 +
** 3-(4-hydroxyphemyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-7775]]
+
* [[APIGNAR-RXN]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[NARINGENIN-CHALCONE-SYNTHASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* CAS : 73692-50-9
 +
* LIPID_MAPS : LMPK12120264
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657147 90657147]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5280960 5280960]
* CHEBI:
+
* HMDB : HMDB29631
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28412 28412]
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C05631 C05631]
+
** [http://www.genome.jp/dbget-bin/www_bget?C06561 C06561]
* HMDB : HMDB05810
+
* CHEMSPIDER:
{{#set: smiles=C3(C(C2(OC1(C=C(C=C(C=1C(C2)=O)O)[O-])))=CC(=C(C=3)O)O)}}
+
** [http://www.chemspider.com/Chemical-Structure.4444447.html 4444447]
{{#set: inchi key=InChIKey=SBHXYTNGIZCORC-ZDUSSCGKSA-M}}
+
* CHEBI:
{{#set: common name=(2S)-eriodictyol}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15413 15413]
{{#set: molecular weight=287.248   }}
+
* METABOLIGHTS : MTBLC15413
{{#set: consumed by=RXN-7775}}
+
{{#set: smiles=C2(C(C=CC(C1(C(=CC(=CC(O)=1)O)O))=O)=CC=C(C=2)O)}}
 +
{{#set: inchi key=InChIKey=YQHMWTPYORBCMF-ZZXKWVIFSA-N}}
 +
{{#set: common name=2',4,4',6'-tetrahydroxychalcone}}
 +
{{#set: molecular weight=272.257   }}
 +
{{#set: common name=naringenin chalcone|chalconaringenin|2'4'6'4-Tetrahydroxychalcone|Isosalipurpol|tetrahydroxychalcone|3-(4-hydroxyphemyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one}}
 +
{{#set: consumed by=APIGNAR-RXN}}
 +
{{#set: produced by=NARINGENIN-CHALCONE-SYNTHASE-RXN}}

Latest revision as of 19:56, 21 March 2018

Metabolite APIGENIN

  • smiles:
    • C2(C(C=CC(C1(C(=CC(=CC(O)=1)O)O))=O)=CC=C(C=2)O)
  • inchi key:
    • InChIKey=YQHMWTPYORBCMF-ZZXKWVIFSA-N
  • common name:
    • 2',4,4',6'-tetrahydroxychalcone
  • molecular weight:
    • 272.257
  • Synonym(s):
    • naringenin chalcone
    • chalconaringenin
    • 2'4'6'4-Tetrahydroxychalcone
    • Isosalipurpol
    • tetrahydroxychalcone
    • 3-(4-hydroxyphemyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 73692-50-9
  • LIPID_MAPS : LMPK12120264
  • PUBCHEM:
  • HMDB : HMDB29631
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC15413