Difference between revisions of "CPD-3481"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4441 CPD-4441] == * smiles: ** CC(CO)=CCNC2(C1(=C(NC=N1)N=CN=2)) * inchi key: ** InChIKey=U...")
 
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-4441 CPD-4441] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-3481 CPD-3481] ==
 
* smiles:
 
* smiles:
−
** CC(CO)=CCNC2(C1(=C(NC=N1)N=CN=2))
+
** CC([N+]C(C)(C)C)C(=O)C1(C=CC=C(Cl)C=1)
 +
* molecular weight:
 +
** 240.752   
 
* inchi key:
 
* inchi key:
−
** InChIKey=UZKQTCBAMSWPJD-UQCOIBPSSA-N
+
** InChIKey=SNPPWIUOZRMYNY-UHFFFAOYSA-O
 
* common name:
 
* common name:
−
** cis-zeatin
+
** bupropion
−
* molecular weight:
+
−
** 219.246   
+
 
* Synonym(s):
 
* Synonym(s):
−
** (Z)-2-methyl-4-(1H-purin-6-ylamino)but-2-en-1-ol
+
** (-)-2-(tert-butylamino)-3'-chloropropiophenone
−
** cZ
+
** 1-propanone, 1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-,(+-)-
 +
** (+-)-1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone
 +
** amfebutamonum
 +
** α-(tert-butylamino)-m-chloropropiophenone
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-4733]]
+
* [[RXN66-181]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* PUBCHEM:
 
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=688597 688597]
 
−
* HMDB : HMDB12204
 
−
* LIGAND-CPD:
 
−
** [http://www.genome.jp/dbget-bin/www_bget?C15545 C15545]
 
−
* CHEMSPIDER:
 
−
** [http://www.chemspider.com/Chemical-Structure.600017.html 600017]
 
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=46570 46570]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=3219 3219]
−
* METABOLIGHTS : MTBLC46570
+
* LIGAND-CPD:
−
{{#set: smiles=CC(CO)=CCNC2(C1(=C(NC=N1)N=CN=2))}}
+
** [http://www.genome.jp/dbget-bin/www_bget?C06860 C06860]
−
{{#set: inchi key=InChIKey=UZKQTCBAMSWPJD-UQCOIBPSSA-N}}
+
* PUBCHEM:
−
{{#set: common name=cis-zeatin}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=24849133 24849133]
−
{{#set: molecular weight=219.246    }}
+
* DRUGBANK : DB01156
−
{{#set: common name=(Z)-2-methyl-4-(1H-purin-6-ylamino)but-2-en-1-ol|cZ}}
+
* HMDB : HMDB01510
−
{{#set: consumed by=RXN-4733}}
+
{{#set: smiles=CC([N+]C(C)(C)C)C(=O)C1(C=CC=C(Cl)C=1)}}
 +
{{#set: molecular weight=240.752    }}
 +
{{#set: inchi key=InChIKey=SNPPWIUOZRMYNY-UHFFFAOYSA-O}}
 +
{{#set: common name=bupropion}}
 +
{{#set: common name=(-)-2-(tert-butylamino)-3'-chloropropiophenone|1-propanone, 1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-,(+-)-|(+-)-1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone|amfebutamonum|α-(tert-butylamino)-m-chloropropiophenone}}
 +
{{#set: consumed by=RXN66-181}}

Latest revision as of 19:03, 9 January 2019

Metabolite CPD-3481

  • smiles:
    • CC([N+]C(C)(C)C)C(=O)C1(C=CC=C(Cl)C=1)
  • molecular weight:
    • 240.752
  • inchi key:
    • InChIKey=SNPPWIUOZRMYNY-UHFFFAOYSA-O
  • common name:
    • bupropion
  • Synonym(s):
    • (-)-2-(tert-butylamino)-3'-chloropropiophenone
    • 1-propanone, 1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-,(+-)-
    • (+-)-1-(3-chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone
    • amfebutamonum
    • α-(tert-butylamino)-m-chloropropiophenone

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC([N+]C(C)(C)C)C(=O)C1(C=CC=C(Cl)C=1)" cannot be used as a page name in this wiki.



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