Difference between revisions of "AMMONIUM"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=44-DIMETHYL-CHOLESTA-812-24-TRIENOL 44-DIMETHYL-CHOLESTA-812-24-TRIENOL] == * smiles: ** CC(C)=...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6991 CPD-6991] == * smiles: ** C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2)=O)O)[O-])))=CC=3) * inchi ke...")
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=44-DIMETHYL-CHOLESTA-812-24-TRIENOL 44-DIMETHYL-CHOLESTA-812-24-TRIENOL] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6991 CPD-6991] ==
 
* smiles:
 
* smiles:
−
** CC(C)=CCCC([CH]1(C2(C)(C(=CC1)C4(=C(CC2)C3([CH](C(C)(C)C(O)CC3)CC4)(C)))))C
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** C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2)=O)O)[O-])))=CC=3)
 
* inchi key:
 
* inchi key:
−
** InChIKey=LFQXEZVYNCBVDO-PBJLWWPKSA-N
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** InChIKey=URFCJEUYXNAHFI-ZDUSSCGKSA-M
 
* common name:
 
* common name:
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** 4,4-dimethyl-cholesta-8,12,24-trienol
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** (2S)-pinocembrin
 
* molecular weight:
 
* molecular weight:
−
** 410.682    
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** 255.249    
 
* Synonym(s):
 
* Synonym(s):
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** 17-(1,5-dimethylhex-4-enyl)-4,4,10,13-tetramethyl-2,3,4,5,6,7, 10,11,12,13,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
 
−
** 4,4-dimethyl-5α-cholesta-8,14,24-trien-3β-ol
 
−
** 4,4-dimethyl-5-α-cholesta-8,14,24-trien-3-β-ol
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN66-306]]
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* [[RXN-7648]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN3O-130]]
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* [[RXN-7647]]
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* [[RXN66-305]]
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== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 +
* LIPID_MAPS : LMPK12140214
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=443212 443212]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25200438 25200438]
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* CHEBI:
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* HMDB : HMDB30808
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=17813 17813]
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C11455 C11455]
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** [http://www.genome.jp/dbget-bin/www_bget?C09827 C09827]
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* HMDB : HMDB01023
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* CHEBI:
−
{{#set: smiles=CC(C)=CCCC([CH]1(C2(C)(C(=CC1)C4(=C(CC2)C3([CH](C(C)(C)C(O)CC3)CC4)(C)))))C}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28157 28157]
−
{{#set: inchi key=InChIKey=LFQXEZVYNCBVDO-PBJLWWPKSA-N}}
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* METABOLIGHTS : MTBLC28157
−
{{#set: common name=4,4-dimethyl-cholesta-8,12,24-trienol}}
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{{#set: smiles=C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2)=O)O)[O-])))=CC=3)}}
−
{{#set: molecular weight=410.682   }}
+
{{#set: inchi key=InChIKey=URFCJEUYXNAHFI-ZDUSSCGKSA-M}}
−
{{#set: common name=17-(1,5-dimethylhex-4-enyl)-4,4,10,13-tetramethyl-2,3,4,5,6,7, 10,11,12,13,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol|4,4-dimethyl-5α-cholesta-8,14,24-trien-3β-ol|4,4-dimethyl-5-α-cholesta-8,14,24-trien-3-β-ol}}
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{{#set: common name=(2S)-pinocembrin}}
−
{{#set: consumed by=RXN66-306}}
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{{#set: molecular weight=255.249   }}
−
{{#set: produced by=RXN3O-130|RXN66-305}}
+
{{#set: consumed by=RXN-7648}}
 +
{{#set: produced by=RXN-7647}}

Revision as of 14:26, 21 March 2018

Metabolite CPD-6991

  • smiles:
    • C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2)=O)O)[O-])))=CC=3)
  • inchi key:
    • InChIKey=URFCJEUYXNAHFI-ZDUSSCGKSA-M
  • common name:
    • (2S)-pinocembrin
  • molecular weight:
    • 255.249
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • LIPID_MAPS : LMPK12140214
  • PUBCHEM:
  • HMDB : HMDB30808
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC28157
"C3(C=CC(C2(OC1(=CC(=CC(=C1C(C2)=O)O)[O-])))=CC=3)" cannot be used as a page name in this wiki.



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