Difference between revisions of "CPD-716"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=INDOLE INDOLE] == * smiles: ** C2(C=CC1(=C(C=CN1)C=2)) * common name: ** indole * inchi key: **...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-716 CPD-716] == * smiles: ** CC(C)C(C)C(O)C(O)C(C)[CH]3(CC[CH]4([CH]2(CC(=O)[CH]1(CC(O)CCC(...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=INDOLE INDOLE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-716 CPD-716] ==
 
* smiles:
 
* smiles:
** C2(C=CC1(=C(C=CN1)C=2))
+
** CC(C)C(C)C(O)C(O)C(C)[CH]3(CC[CH]4([CH]2(CC(=O)[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))
 
* common name:
 
* common name:
** indole
+
** teasterone
 
* inchi key:
 
* inchi key:
** InChIKey=SIKJAQJRHWYJAI-UHFFFAOYSA-N
+
** InChIKey=SBSXXCCMIWEPEE-GZKYLSGOSA-N
 
* molecular weight:
 
* molecular weight:
** 117.15    
+
** 448.685    
 
* Synonym(s):
 
* Synonym(s):
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN0-2382]]
+
* [[RXN-717]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN-716]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[RXN0-2381]]
 
 
== External links  ==
 
== External links  ==
* CAS : 120-72-9
 
* DRUGBANK : DB04532
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=798 798]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=13475125 13475125]
* HMDB : HMDB00738
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C00463 C00463]
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* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.776.html 776]
+
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16881 16881]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=26863 26863]
* BIGG : indole
+
* LIGAND-CPD:
{{#set: smiles=C2(C=CC1(=C(C=CN1)C=2))}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C15791 C15791]
{{#set: common name=indole}}
+
{{#set: smiles=CC(C)C(C)C(O)C(O)C(C)[CH]3(CC[CH]4([CH]2(CC(=O)[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))}}
{{#set: inchi key=InChIKey=SIKJAQJRHWYJAI-UHFFFAOYSA-N}}
+
{{#set: common name=teasterone}}
{{#set: molecular weight=117.15   }}
+
{{#set: inchi key=InChIKey=SBSXXCCMIWEPEE-GZKYLSGOSA-N}}
{{#set: consumed by=RXN0-2382}}
+
{{#set: molecular weight=448.685   }}
{{#set: reversible reaction associated=RXN0-2381}}
+
{{#set: consumed by=RXN-717}}
 +
{{#set: produced by=RXN-716}}

Latest revision as of 19:53, 21 March 2018

Metabolite CPD-716

  • smiles:
    • CC(C)C(C)C(O)C(O)C(C)[CH]3(CC[CH]4([CH]2(CC(=O)[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))
  • common name:
    • teasterone
  • inchi key:
    • InChIKey=SBSXXCCMIWEPEE-GZKYLSGOSA-N
  • molecular weight:
    • 448.685
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)C(C)C(O)C(O)C(C)[CH]3(CC[CH]4([CH]2(CC(=O)[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))" cannot be used as a page name in this wiki.