Difference between revisions of "CPD-14115"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14115 CPD-14115] == * smiles: ** C3(C(C1(CC2(=CC=C(C=C(OC1)2)O)))=CC=C(C=3)O) * inchi key:...")
 
(2 intermediate revisions by the same user not shown)
Line 1: Line 1:
[[Category:Pathway]]
+
[[Category:Metabolite]]
== Pathway [http://metacyc.org/META/NEW-IMAGE?object=PWY-7533 PWY-7533] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-14115 CPD-14115] ==
* taxonomic range:
+
* smiles:
** [http://metacyc.org/META/NEW-IMAGE?object=TAX-1131492 TAX-1131492]
+
** C3(C(C1(CC2(=CC=C(C=C(OC1)2)O)))=CC=C(C=3)O)
** [http://metacyc.org/META/NEW-IMAGE?object=TAX-4751 TAX-4751]
+
* inchi key:
 +
** InChIKey=ADFCQWZHKCXPAJ-GFCCVEGCSA-N
 
* common name:
 
* common name:
** gliotoxin biosynthesis
+
** (S)-equol
 +
* molecular weight:
 +
** 242.274   
 
* Synonym(s):
 
* Synonym(s):
 +
** 4',7-isoflavandiol
  
== Reaction(s) found ==
+
== Reaction(s) known to consume the compound ==
'''3''' reactions found over '''9''' reactions in the full pathway
+
== Reaction(s) known to produce the compound ==
* [[RXN-15680]]
+
== Reaction(s) of unknown directionality ==
* [[RXN-15681]]
+
* [[RXN-15589]]
* [[RXN-15684]]
+
== Reaction(s) not found ==
+
* [http://metacyc.org/META/NEW-IMAGE?object=RXN-15678 RXN-15678]
+
* [http://metacyc.org/META/NEW-IMAGE?object=RXN-15679 RXN-15679]
+
* [http://metacyc.org/META/NEW-IMAGE?object=RXN-15682 RXN-15682]
+
* [http://metacyc.org/META/NEW-IMAGE?object=RXN-15683 RXN-15683]
+
* [http://metacyc.org/META/NEW-IMAGE?object=RXN-15685 RXN-15685]
+
* [http://metacyc.org/META/NEW-IMAGE?object=RXN-15686 RXN-15686]
+
 
== External links  ==
 
== External links  ==
{{#set: taxonomic range=TAX-1131492}}
+
* LIGAND-CPD:
{{#set: taxonomic range=TAX-4751}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C14131 C14131]
{{#set: common name=gliotoxin biosynthesis}}
+
* Wikipedia : Equol
{{#set: reaction found=3}}
+
* HMDB : HMDB02209
{{#set: reaction not found=9}}
+
* CHEBI:
{{#set: completion rate=33.0}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=34741 34741]
 +
* PUBCHEM:
 +
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91469 91469]
 +
{{#set: smiles=C3(C(C1(CC2(=CC=C(C=C(OC1)2)O)))=CC=C(C=3)O)}}
 +
{{#set: inchi key=InChIKey=ADFCQWZHKCXPAJ-GFCCVEGCSA-N}}
 +
{{#set: common name=(S)-equol}}
 +
{{#set: molecular weight=242.274    }}
 +
{{#set: common name=4',7-isoflavandiol}}
 +
{{#set: reversible reaction associated=RXN-15589}}

Latest revision as of 19:08, 21 March 2018

Metabolite CPD-14115

  • smiles:
    • C3(C(C1(CC2(=CC=C(C=C(OC1)2)O)))=CC=C(C=3)O)
  • inchi key:
    • InChIKey=ADFCQWZHKCXPAJ-GFCCVEGCSA-N
  • common name:
    • (S)-equol
  • molecular weight:
    • 242.274
  • Synonym(s):
    • 4',7-isoflavandiol

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIGAND-CPD:
  • Wikipedia : Equol
  • HMDB : HMDB02209
  • CHEBI:
  • PUBCHEM: