Difference between revisions of "17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-520 CPD-520] == * smiles: ** C1(C=C(O)C(O)=CC=1C2(OC3(=C(C(=O)C=2[O-])C(O)=CC(O)=C3))) * co...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O 17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O] == * smiles: ** CC34...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-520 CPD-520] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O 17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O] ==
 
* smiles:
 
* smiles:
−
** C1(C=C(O)C(O)=CC=1C2(OC3(=C(C(=O)C=2[O-])C(O)=CC(O)=C3)))
+
** CC34([CH]2([CH]([CH]1(C(C)(C(O)CC1)CC2))CC[CH]3CC(=O)CC4))
 
* common name:
 
* common name:
−
** quercetin
+
** 17-β-hydroxy-5-α-androstan-3-one
 
* inchi key:
 
* inchi key:
−
** InChIKey=REFJWTPEDVJJIY-UHFFFAOYSA-M
+
** InChIKey=NVKAWKQGWWIWPM-ABEVXSGRSA-N
 
* molecular weight:
 
* molecular weight:
−
** 301.232    
+
** 290.445    
 
* Synonym(s):
 
* Synonym(s):
−
** 3,5,7,3',4'-pentahydroxyflavone
+
** 17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,10,11,12,13,14,15,16, 17-hexadecahydrocyclopenta[a]phenanthren-3-one
−
** 3,5,7,3',4'-pentahydroflavone
+
** 17-β-hydroxyandrostan-3-one
 +
** 5-α-dihydrotestosterone
 +
** dihydrotestosteron
 +
** androstanolone
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[QUERCETIN-3-O-METHYLTRANSFERASE-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-527]]
+
* [[RXN66-343]]
−
* [[RXN-12510]]
+
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* LIPID_MAPS : LMST02020042
 +
* DRUGBANK : DB02901
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=46906036 46906036]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=10635 10635]
−
* CAS : 117-39-5
+
* HMDB : HMDB02961
−
* Wikipedia : Quercetin
+
−
* NCI:
+
−
** [http://cactus.nci.nih.gov/ncidb2.2/?nsc=9219 9219]
+
−
* HMDB : HMDB05794
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C00389 C00389]
+
** [http://www.genome.jp/dbget-bin/www_bget?C03917 C03917]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.10189.html 10189]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57694 57694]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16330 16330]
−
{{#set: smiles=C1(C=C(O)C(O)=CC=1C2(OC3(=C(C(=O)C=2[O-])C(O)=CC(O)=C3)))}}
+
* METABOLIGHTS : MTBLC16330
−
{{#set: common name=quercetin}}
+
{{#set: smiles=CC34([CH]2([CH]([CH]1(C(C)(C(O)CC1)CC2))CC[CH]3CC(=O)CC4))}}
−
{{#set: inchi key=InChIKey=REFJWTPEDVJJIY-UHFFFAOYSA-M}}
+
{{#set: common name=17-β-hydroxy-5-α-androstan-3-one}}
−
{{#set: molecular weight=301.232   }}
+
{{#set: inchi key=InChIKey=NVKAWKQGWWIWPM-ABEVXSGRSA-N}}
−
{{#set: common name=3,5,7,3',4'-pentahydroxyflavone|3,5,7,3',4'-pentahydroflavone}}
+
{{#set: molecular weight=290.445   }}
−
{{#set: consumed by=QUERCETIN-3-O-METHYLTRANSFERASE-RXN}}
+
{{#set: common name=17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,10,11,12,13,14,15,16, 17-hexadecahydrocyclopenta[a]phenanthren-3-one|17-β-hydroxyandrostan-3-one|5-α-dihydrotestosterone|dihydrotestosteron|androstanolone}}
−
{{#set: produced by=RXN-527|RXN-12510}}
+
{{#set: produced by=RXN66-343}}

Latest revision as of 21:23, 21 March 2018

Metabolite 17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O

  • smiles:
    • CC34([CH]2([CH]([CH]1(C(C)(C(O)CC1)CC2))CC[CH]3CC(=O)CC4))
  • common name:
    • 17-β-hydroxy-5-α-androstan-3-one
  • inchi key:
    • InChIKey=NVKAWKQGWWIWPM-ABEVXSGRSA-N
  • molecular weight:
    • 290.445
  • Synonym(s):
    • 17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,10,11,12,13,14,15,16, 17-hexadecahydrocyclopenta[a]phenanthren-3-one
    • 17-β-hydroxyandrostan-3-one
    • 5-α-dihydrotestosterone
    • dihydrotestosteron
    • androstanolone

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIPID_MAPS : LMST02020042
  • DRUGBANK : DB02901
  • PUBCHEM:
  • HMDB : HMDB02961
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC16330
"CC34([CH]2([CH]([CH]1(C(C)(C(O)CC1)CC2))CC[CH]3CC(=O)CC4))" cannot be used as a page name in this wiki.


"17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,10,11,12,13,14,15,16, 17-hexadecahydrocyclopenta[a]phenanthren-3-one" cannot be used as a page name in this wiki.
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