Difference between revisions of "PREGNENOLONE"

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(Created page with "Category:Pathway == Pathway [http://metacyc.org/META/NEW-IMAGE?object=QUINATEDEG-PWY QUINATEDEG-PWY] == * taxonomic range: ** [http://metacyc.org/META/NEW-IMAGE?object=TAX...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PREGNENOLONE PREGNENOLONE] == * smiles: ** CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC...")
 
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[[Category:Pathway]]
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[[Category:Metabolite]]
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== Pathway [http://metacyc.org/META/NEW-IMAGE?object=QUINATEDEG-PWY QUINATEDEG-PWY] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PREGNENOLONE PREGNENOLONE] ==
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* taxonomic range:
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* smiles:
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** [http://metacyc.org/META/NEW-IMAGE?object=TAX-2 TAX-2]
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** CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))
 
* common name:
 
* common name:
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** quinate degradation I
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** pregnenolone
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* inchi key:
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** InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N
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* molecular weight:
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** 316.483   
 
* Synonym(s):
 
* Synonym(s):
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** 1-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16, 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)]ethanone
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** 5-pregnen-3-β-ol-20-one
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** 3-β-hydroxypregn-5-en-20-one
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** 3beta-hydroxypregn-5-en-20-one
  
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== Reaction(s) found ==
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== Reaction(s) known to consume the compound ==
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'''1''' reactions found over '''3''' reactions in the full pathway
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* [[RXN66-353]]
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* [[3-DEHYDROQUINATE-DEHYDRATASE-RXN]]
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== Reaction(s) known to produce the compound ==
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** 5 associated gene(s):
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== Reaction(s) of unknown directionality ==
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*** [[Tiso_gene_14718]]
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*** [[Tiso_gene_5752]]
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*** [[Tiso_gene_5753]]
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*** [[Tiso_gene_5619]]
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*** [[Tiso_gene_8720]]
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** 4 reconstruction source(s) associated:
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*** [[orthology-athaliana]]
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*** [[annotation-in-silico_annotation]]
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*** [[manual-primary_network]]
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*** [[orthology-esiliculosus]]
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== Reaction(s) not found ==
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* [http://metacyc.org/META/NEW-IMAGE?object=1.1.99.25-RXN 1.1.99.25-RXN]
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* [http://metacyc.org/META/NEW-IMAGE?object=DHSHIKIMATE-DEHYDRO-RXN DHSHIKIMATE-DEHYDRO-RXN]
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== External links  ==
 
== External links  ==
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{{#set: taxonomic range=TAX-2}}
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* LIPID_MAPS : LMST02030088
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{{#set: common name=quinate degradation I}}
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* CAS : 145-13-1
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{{#set: reaction found=1}}
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* Wikipedia : Pregnenolone
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{{#set: total reaction=3}}
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* DRUGBANK : DB02789
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{{#set: completion rate=33.0}}
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* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=8955 8955]
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* HMDB : HMDB00253
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C01953 C01953]
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* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.8611.html 8611]
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* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16581 16581]
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* METABOLIGHTS : MTBLC16581
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{{#set: smiles=CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))}}
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{{#set: common name=pregnenolone}}
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{{#set: inchi key=InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N}}
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{{#set: molecular weight=316.483    }}
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{{#set: common name=1-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16, 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)]ethanone|5-pregnen-3-β-ol-20-one|3-β-hydroxypregn-5-en-20-one|3beta-hydroxypregn-5-en-20-one}}
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{{#set: consumed by=RXN66-353}}

Latest revision as of 19:20, 21 March 2018

Metabolite PREGNENOLONE

  • smiles:
    • CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))
  • common name:
    • pregnenolone
  • inchi key:
    • InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N
  • molecular weight:
    • 316.483
  • Synonym(s):
    • 1-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16, 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)]ethanone
    • 5-pregnen-3-β-ol-20-one
    • 3-β-hydroxypregn-5-en-20-one
    • 3beta-hydroxypregn-5-en-20-one

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIPID_MAPS : LMST02030088
  • CAS : 145-13-1
  • Wikipedia : Pregnenolone
  • DRUGBANK : DB02789
  • PUBCHEM:
  • HMDB : HMDB00253
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16581
"CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))" cannot be used as a page name in this wiki.


"1-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16, 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)]ethanone" cannot be used as a page name in this wiki.
Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=PREGNENOLONE&oldid=41025"