Difference between revisions of "PREGNENOLONE"

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(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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* smiles:
 
* smiles:
 
** CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))
 
** 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:
 
* molecular weight:
 
** 316.483     
 
** 316.483     
 +
* inchi key:
 +
** InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N
 +
* common name:
 +
** pregnenolone
 
* Synonym(s):
 
* 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
 
** 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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== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN66-353]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN66-353]]
 
== External links  ==
 
== External links  ==
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.8611.html 8611]
 +
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16581 16581]
 +
* DRUGBANK : DB02789
 +
* REFMET : Pregnenolone
 
* LIPID_MAPS : LMST02030088
 
* LIPID_MAPS : LMST02030088
−
* CAS : 145-13-1
 
 
* Wikipedia : Pregnenolone
 
* Wikipedia : Pregnenolone
−
* DRUGBANK : DB02789
+
* METABOLIGHTS : MTBLC16581
 +
* CAS : 145-13-1
 
* PUBCHEM:
 
* PUBCHEM:
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=8955 8955]
 
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=8955 8955]
−
* HMDB : HMDB00253
 
 
* LIGAND-CPD:
 
* LIGAND-CPD:
 
** [http://www.genome.jp/dbget-bin/www_bget?C01953 C01953]
 
** [http://www.genome.jp/dbget-bin/www_bget?C01953 C01953]
−
* CHEMSPIDER:
+
* HMDB : HMDB00253
−
** [http://www.chemspider.com/Chemical-Structure.8611.html 8611]
+
−
* CHEBI:
+
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16581 16581]
+
−
* METABOLIGHTS : MTBLC16581
+
 
{{#set: smiles=CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))}}
 
{{#set: smiles=CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))}}
−
{{#set: common name=pregnenolone}}
 
−
{{#set: inchi key=InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N}}
 
 
{{#set: molecular weight=316.483    }}
 
{{#set: molecular weight=316.483    }}
 +
{{#set: inchi key=InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N}}
 +
{{#set: common name=pregnenolone}}
 
{{#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}}
 
{{#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}}
−
{{#set: consumed by=RXN66-353}}
+
{{#set: reversible reaction associated=RXN66-353}}

Latest revision as of 11:28, 10 January 2019

Metabolite PREGNENOLONE

  • smiles:
    • CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))
  • molecular weight:
    • 316.483
  • inchi key:
    • InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N
  • common name:
    • pregnenolone
  • 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

  • CHEMSPIDER:
  • CHEBI:
  • DRUGBANK : DB02789
  • REFMET : Pregnenolone
  • LIPID_MAPS : LMST02030088
  • Wikipedia : Pregnenolone
  • METABOLIGHTS : MTBLC16581
  • CAS : 145-13-1
  • PUBCHEM:
  • LIGAND-CPD:
  • HMDB : HMDB00253
"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.
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