Difference between revisions of "Tiso gene 8"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=N-ACETYL-9-O-ACETYLNEURAMINATE N-ACETYL-9-O-ACETYLNEURAMINATE] == * smiles: ** CC(NC1(C(CC(O)(C...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HEXANOYL-COA HEXANOYL-COA] == * smiles: ** CCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=N-ACETYL-9-O-ACETYLNEURAMINATE N-ACETYL-9-O-ACETYLNEURAMINATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HEXANOYL-COA HEXANOYL-COA] ==
 
* smiles:
 
* smiles:
−
** CC(NC1(C(CC(O)(C(=O)[O-])OC1C(C(COC(=O)C)O)O)O))=O
+
** CCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
−
* inchi key:
+
−
** InChIKey=NYWZBRWKDRMPAS-GYQVTDHRSA-M
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* common name:
 
* common name:
−
** N-acetyl-9-O-acetylneuraminate
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** hexanoyl-CoA
 +
* inchi key:
 +
** InChIKey=OEXFMSFODMQEPE-HDRQGHTBSA-J
 
* molecular weight:
 
* molecular weight:
−
** 350.302    
+
** 861.647    
 
* Synonym(s):
 
* Synonym(s):
 +
** hexanoyl-coenzyme A
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[RXN-13182]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-14278]]
 +
* [[RXN-14277]]
 
== External links  ==
 
== External links  ==
 +
* CAS : 5060-32-2
 +
* BIGG : hxcoa
 +
* DRUGBANK : DB02563
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25244648 25244648]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=53262356 53262356]
−
* CHEBI:
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* HMDB : HMDB02845
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28999 28999]
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C04017 C04017]
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** [http://www.genome.jp/dbget-bin/www_bget?C05270 C05270]
−
{{#set: smiles=CC(NC1(C(CC(O)(C(=O)[O-])OC1C(C(COC(=O)C)O)O)O))=O}}
+
* CHEBI:
−
{{#set: inchi key=InChIKey=NYWZBRWKDRMPAS-GYQVTDHRSA-M}}
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62620 62620]
−
{{#set: common name=N-acetyl-9-O-acetylneuraminate}}
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* METABOLIGHTS : MTBLC27540
−
{{#set: molecular weight=350.302   }}
+
{{#set: smiles=CCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]}}
−
{{#set: consumed by=RXN-13182}}
+
{{#set: common name=hexanoyl-CoA}}
 +
{{#set: inchi key=InChIKey=OEXFMSFODMQEPE-HDRQGHTBSA-J}}
 +
{{#set: molecular weight=861.647   }}
 +
{{#set: common name=hexanoyl-coenzyme A}}
 +
{{#set: reversible reaction associated=RXN-14278|RXN-14277}}

Revision as of 15:33, 21 March 2018

Metabolite HEXANOYL-COA

  • smiles:
    • CCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]
  • common name:
    • hexanoyl-CoA
  • inchi key:
    • InChIKey=OEXFMSFODMQEPE-HDRQGHTBSA-J
  • molecular weight:
    • 861.647
  • Synonym(s):
    • hexanoyl-coenzyme A

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 5060-32-2
  • BIGG : hxcoa
  • DRUGBANK : DB02563
  • PUBCHEM:
  • HMDB : HMDB02845
  • LIGAND-CPD:
  • CHEBI:
  • METABOLIGHTS : MTBLC27540
"CCCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-" cannot be used as a page name in this wiki.



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