Difference between revisions of "2-METHYL-BUTYRYL-COA"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-771 CPD1G-771] == * smiles: ** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-METHYL-BUTYRYL-COA 2-METHYL-BUTYRYL-COA] == * smiles: ** CCC(C)C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD1G-771 CPD1G-771] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=2-METHYL-BUTYRYL-COA 2-METHYL-BUTYRYL-COA] ==
 
* smiles:
 
* smiles:
** CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)
+
** CCC(C)C(=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:
 
* inchi key:
** InChIKey=NYSGJFYKJQFMRN-ZVNWTMLTSA-L
+
** InChIKey=LYNVNYDEQMMNMZ-XGXNYEOVSA-J
 
* common name:
 
* common name:
** 6-O-cis-methoxy-mycolyl-trehalose 6-phosphate
+
** 2-methylbutanoyl-CoA
 
* molecular weight:
 
* molecular weight:
** 1656.508    
+
** 847.62    
 
* Synonym(s):
 
* Synonym(s):
 +
** S-2-methyl-butyryl-CoA
 +
** 2-methylbutyryl-CoA
 +
** α-methylbutyryl-CoA
 +
** α-methylbutanoyl-CoA
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN1G-1436]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[MBCOA-DHLIPOAMIDE-RXN]]
 +
* [[2KETO-3METHYLVALERATE-RXN]]
 +
* [[2-METHYLACYL-COA-DEHYDROGENASE-RXN]]
 
== External links  ==
 
== External links  ==
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657776 90657776]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266569 45266569]
{{#set: smiles=CCCCCCCCCCCCCCCCCCCCCCCCC(C(OCC1(OC(C(C(C1O)O)O)OC2(C(C(C(C(O2)COP([O-])(=O)[O-])O)O)O)))=O)C(O)CCCCCCCCCCCCCCCCCC3(C(CCCCCCCCCCCCCCCCC(OC)C(C)CCCCCCCCCCCCCCCCCC)C3)}}
+
* CHEBI:
{{#set: inchi key=InChIKey=NYSGJFYKJQFMRN-ZVNWTMLTSA-L}}
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57336 57336]
{{#set: common name=6-O-cis-methoxy-mycolyl-trehalose 6-phosphate}}
+
* LIGAND-CPD:
{{#set: molecular weight=1656.508   }}
+
** [http://www.genome.jp/dbget-bin/www_bget?C01033 C01033]
{{#set: consumed by=RXN1G-1436}}
+
* HMDB : HMDB01041
 +
{{#set: smiles=CCC(C)C(=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: inchi key=InChIKey=LYNVNYDEQMMNMZ-XGXNYEOVSA-J}}
 +
{{#set: common name=2-methylbutanoyl-CoA}}
 +
{{#set: molecular weight=847.62   }}
 +
{{#set: common name=S-2-methyl-butyryl-CoA|2-methylbutyryl-CoA|α-methylbutyryl-CoA|α-methylbutanoyl-CoA}}
 +
{{#set: reversible reaction associated=MBCOA-DHLIPOAMIDE-RXN|2KETO-3METHYLVALERATE-RXN|2-METHYLACYL-COA-DEHYDROGENASE-RXN}}

Latest revision as of 19:04, 21 March 2018

Metabolite 2-METHYL-BUTYRYL-COA

  • smiles:
    • CCC(C)C(=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=LYNVNYDEQMMNMZ-XGXNYEOVSA-J
  • common name:
    • 2-methylbutanoyl-CoA
  • molecular weight:
    • 847.62
  • Synonym(s):
    • S-2-methyl-butyryl-CoA
    • 2-methylbutyryl-CoA
    • α-methylbutyryl-CoA
    • α-methylbutanoyl-CoA

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCC(C)C(=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.