Difference between revisions of "CPD-6972"

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(Created page with "Category:Gene == Gene Tiso_gene_9140 == * left end position: ** 6694 * transcription direction: ** POSITIVE * right end position: ** 8924 * centisome position: ** 69.94775...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6972 CPD-6972] == * smiles: ** CC(COP([O-])(=O)OP([O-])(=O)OCC3(C(C(C(N2(C=NC1(C(=NC=NC=12)...")
 
(One intermediate revision by the same user not shown)
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[[Category:Gene]]
+
[[Category:Metabolite]]
== Gene Tiso_gene_9140 ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-6972 CPD-6972] ==
* left end position:
+
* smiles:
** 6694
+
** CC(COP([O-])(=O)OP([O-])(=O)OCC3(C(C(C(N2(C=NC1(C(=NC=NC=12)N)))O3)O)OP([O-])(=O)[O-]))(C)C(C(NCCC(NCCSC(CCC(C4(C=CC=CC(C([O-])=O)=4))=O)=O)=O)=O)O
* transcription direction:
+
* common name:
** POSITIVE
+
** 4-(2'-carboxyphenyl)-4-oxobutyryl-CoA
* right end position:
+
* inchi key:
** 8924
+
** InChIKey=KVAQAPQXOXTRAE-UHFFFAOYSA-I
* centisome position:
+
* molecular weight:
** 69.947754    
+
** 966.676    
 
* Synonym(s):
 
* Synonym(s):
 +
** succinylbenzoyl-CoA
 +
** 2-succinylbenzoyl-CoA
 +
** 2-(3'-carboxypropionyl)benzoyl-CoA
 +
** o-succinylbenzoyl-CoA
  
== Reactions associated ==
+
== Reaction(s) known to consume the compound ==
* [[RXN-12086]]
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* [[NAPHTHOATE-SYN-RXN]]
** in-silico_annotation
+
== Reaction(s) known to produce the compound ==
***ec-number
+
== Reaction(s) of unknown directionality ==
* [[RXN-12579]]
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** in-silico_annotation
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***ec-number
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* [[TRIACYLGLYCEROL-LIPASE-RXN]]
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** in-silico_annotation
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***ec-number
+
== Pathways associated ==
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* [[LIPAS-PWY]]
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* [[PWY-6857]]
+
 
== External links  ==
 
== External links  ==
{{#set: left end position=6694}}
+
* PUBCHEM:
{{#set: transcription direction=POSITIVE}}
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25245100 25245100]
{{#set: right end position=8924}}
+
* CHEBI:
{{#set: centisome position=69.947754   }}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15509 15509]
{{#set: reaction associated=RXN-12086|RXN-12579|TRIACYLGLYCEROL-LIPASE-RXN}}
+
* BIGG : sbzcoa
{{#set: pathway associated=LIPAS-PWY|PWY-6857}}
+
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C03160 C03160]
 +
{{#set: smiles=CC(COP([O-])(=O)OP([O-])(=O)OCC3(C(C(C(N2(C=NC1(C(=NC=NC=12)N)))O3)O)OP([O-])(=O)[O-]))(C)C(C(NCCC(NCCSC(CCC(C4(C=CC=CC(C([O-])=O)=4))=O)=O)=O)=O)O}}
 +
{{#set: common name=4-(2'-carboxyphenyl)-4-oxobutyryl-CoA}}
 +
{{#set: inchi key=InChIKey=KVAQAPQXOXTRAE-UHFFFAOYSA-I}}
 +
{{#set: molecular weight=966.676   }}
 +
{{#set: common name=succinylbenzoyl-CoA|2-succinylbenzoyl-CoA|2-(3'-carboxypropionyl)benzoyl-CoA|o-succinylbenzoyl-CoA}}
 +
{{#set: consumed by=NAPHTHOATE-SYN-RXN}}

Latest revision as of 21:11, 21 March 2018

Metabolite CPD-6972

  • smiles:
    • CC(COP([O-])(=O)OP([O-])(=O)OCC3(C(C(C(N2(C=NC1(C(=NC=NC=12)N)))O3)O)OP([O-])(=O)[O-]))(C)C(C(NCCC(NCCSC(CCC(C4(C=CC=CC(C([O-])=O)=4))=O)=O)=O)=O)O
  • common name:
    • 4-(2'-carboxyphenyl)-4-oxobutyryl-CoA
  • inchi key:
    • InChIKey=KVAQAPQXOXTRAE-UHFFFAOYSA-I
  • molecular weight:
    • 966.676
  • Synonym(s):
    • succinylbenzoyl-CoA
    • 2-succinylbenzoyl-CoA
    • 2-(3'-carboxypropionyl)benzoyl-CoA
    • o-succinylbenzoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(COP([O-])(=O)OP([O-])(=O)OCC3(C(C(C(N2(C=NC1(C(=NC=NC=12)N)))O3)O)OP([O-])(=O)[O-]))(C)C(C(NCCC(NCCSC(CCC(C4(C=CC=CC(C([O-])=O)=4))=O)=O)=O)=O)O" cannot be used as a page name in this wiki.