Difference between revisions of "CPD1F-96"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-30 CPD-30] == * smiles: ** CC(NCCC[CH]=O)=O * inchi key: ** InChIKey=DDSLGZOYEPKPSJ-UHFFFAO...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-96 CPD1F-96] == * smiles: ** C=C1(C2(O)(CC3(C1)(C([CH]4(C(C)(CCCC(C=O)([CH](CC2)3)4)C([O-...")
 
(2 intermediate revisions by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-30 CPD-30] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1F-96 CPD1F-96] ==
 
* smiles:
 
* smiles:
** CC(NCCC[CH]=O)=O
+
** C=C1(C2(O)(CC3(C1)(C([CH]4(C(C)(CCCC(C=O)([CH](CC2)3)4)C([O-])=O))C([O-])=O)))
* inchi key:
+
** InChIKey=DDSLGZOYEPKPSJ-UHFFFAOYSA-N
+
 
* common name:
 
* common name:
** 4-acetamidobutanal
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** gibberellin A19
 +
* inchi key:
 +
** InChIKey=VNCQCPQAMDQEBY-YTJHIPEWSA-L
 
* molecular weight:
 
* molecular weight:
** 129.158    
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** 360.406    
 
* Synonym(s):
 
* Synonym(s):
** N-acetyl-γ-aminobutyraldehyde
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** GA19
** N-acetyl-4-aminobutanal
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-37]]
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* [[RXN1F-169]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 +
* [[RXN1F-168]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=440850 440850]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25200921 25200921]
* HMDB : HMDB04226
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* HMDB : HMDB36896
* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C05936 C05936]
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* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.389692.html 389692]
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* CHEBI:
 
* CHEBI:
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=7386 7386]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58587 58587]
* METABOLIGHTS : MTBLC7386
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* LIGAND-CPD:
{{#set: smiles=CC(NCCC[CH]=O)=O}}
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** [http://www.genome.jp/dbget-bin/www_bget?C02034 C02034]
{{#set: inchi key=InChIKey=DDSLGZOYEPKPSJ-UHFFFAOYSA-N}}
+
{{#set: smiles=C=C1(C2(O)(CC3(C1)(C([CH]4(C(C)(CCCC(C=O)([CH](CC2)3)4)C([O-])=O))C([O-])=O)))}}
{{#set: common name=4-acetamidobutanal}}
+
{{#set: common name=gibberellin A19}}
{{#set: molecular weight=129.158   }}
+
{{#set: inchi key=InChIKey=VNCQCPQAMDQEBY-YTJHIPEWSA-L}}
{{#set: common name=N-acetyl-γ-aminobutyraldehyde|N-acetyl-4-aminobutanal}}
+
{{#set: molecular weight=360.406   }}
{{#set: consumed by=RXN-37}}
+
{{#set: common name=GA19}}
 +
{{#set: consumed by=RXN1F-169}}
 +
{{#set: produced by=RXN1F-168}}

Latest revision as of 21:14, 21 March 2018

Metabolite CPD1F-96

  • smiles:
    • C=C1(C2(O)(CC3(C1)(C([CH]4(C(C)(CCCC(C=O)([CH](CC2)3)4)C([O-])=O))C([O-])=O)))
  • common name:
    • gibberellin A19
  • inchi key:
    • InChIKey=VNCQCPQAMDQEBY-YTJHIPEWSA-L
  • molecular weight:
    • 360.406
  • Synonym(s):
    • GA19

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"C=C1(C2(O)(CC3(C1)(C([CH]4(C(C)(CCCC(C=O)([CH](CC2)3)4)C([O-])=O))C([O-])=O)))" cannot be used as a page name in this wiki.