Difference between revisions of "CPD66-29"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SPERMINE SPERMINE] == * smiles: ** C(CCC[N+]CCC[N+])[N+]CCC[N+] * inchi key: ** InChIKey=PFNFFQ...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD66-29 CPD66-29] == * smiles: ** CC24(CCC(=O)CC(=CC[CH]1([CH]3(CCC(=O)C(CC[CH]12)(C)3)))4) *...")
 
(3 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=SPERMINE SPERMINE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD66-29 CPD66-29] ==
 
* smiles:
 
* smiles:
** C(CCC[N+]CCC[N+])[N+]CCC[N+]
+
** CC24(CCC(=O)CC(=CC[CH]1([CH]3(CCC(=O)C(CC[CH]12)(C)3)))4)
* inchi key:
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** InChIKey=PFNFFQXMRSDOHW-UHFFFAOYSA-R
+
 
* common name:
 
* common name:
** spermine
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** 5-androstene-3,17-dione
 +
* inchi key:
 +
** InChIKey=SQGZFRITSMYKRH-QAGGRKNESA-N
 
* molecular weight:
 
* molecular weight:
** 206.374    
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** 286.413    
 
* Synonym(s):
 
* Synonym(s):
** gerontine
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** androst-5-ene-3,17-dione
** musculamine
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** neuridine
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** diaminopropyl-tetramethylenediamine
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[SPERMINE-SYNTHASE-RXN]]
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* [[RXN66-342]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* CAS : 71-44-3
 
* DRUGBANK : DB02564
 
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=446718 446718]
 
* HMDB : HMDB01256
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C00750 C00750]
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** [http://www.genome.jp/dbget-bin/www_bget?C20252 C20252]
 
* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.394003.html 394003]
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** [http://www.chemspider.com/Chemical-Structure.543261.html 543261]
 
* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=45725 45725]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=83865 83865]
* METABOLIGHTS : MTBLC45725
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* PUBCHEM:
{{#set: smiles=C(CCC[N+]CCC[N+])[N+]CCC[N+]}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=160531 160531]
{{#set: inchi key=InChIKey=PFNFFQXMRSDOHW-UHFFFAOYSA-R}}
+
{{#set: smiles=CC24(CCC(=O)CC(=CC[CH]1([CH]3(CCC(=O)C(CC[CH]12)(C)3)))4)}}
{{#set: common name=spermine}}
+
{{#set: common name=5-androstene-3,17-dione}}
{{#set: molecular weight=206.374   }}
+
{{#set: inchi key=InChIKey=SQGZFRITSMYKRH-QAGGRKNESA-N}}
{{#set: common name=gerontine|musculamine|neuridine|diaminopropyl-tetramethylenediamine}}
+
{{#set: molecular weight=286.413   }}
{{#set: produced by=SPERMINE-SYNTHASE-RXN}}
+
{{#set: common name=androst-5-ene-3,17-dione}}
 +
{{#set: produced by=RXN66-342}}

Latest revision as of 20:20, 21 March 2018

Metabolite CPD66-29

  • smiles:
    • CC24(CCC(=O)CC(=CC[CH]1([CH]3(CCC(=O)C(CC[CH]12)(C)3)))4)
  • common name:
    • 5-androstene-3,17-dione
  • inchi key:
    • InChIKey=SQGZFRITSMYKRH-QAGGRKNESA-N
  • molecular weight:
    • 286.413
  • Synonym(s):
    • androst-5-ene-3,17-dione

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC24(CCC(=O)CC(=CC[CH]1([CH]3(CCC(=O)C(CC[CH]12)(C)3)))4)" cannot be used as a page name in this wiki.