Difference between revisions of "3-HYDROXY-ISOVALERYL-COA"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DEAMIDO-NAD DEAMIDO-NAD] == * smiles: ** C(OP(=O)([O-])OP(=O)([O-])OCC2(C(O)C(C([N+]1(C=CC=C(C(...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXY-ISOVALERYL-COA 3-HYDROXY-ISOVALERYL-COA] == * smiles: ** CC(COP(=O)([O-])OP(=O)([O-])...")
 
(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=DEAMIDO-NAD DEAMIDO-NAD] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=3-HYDROXY-ISOVALERYL-COA 3-HYDROXY-ISOVALERYL-COA] ==
 
* smiles:
 
* smiles:
−
** C(OP(=O)([O-])OP(=O)([O-])OCC2(C(O)C(C([N+]1(C=CC=C(C([O-])=O)C=1))O2)O))C3(C(O)C(O)C(O3)N5(C=NC4(C(N)=NC=NC=45)))
+
** 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(=O)CC(C)(C)O)=O)=O)O
 
* inchi key:
 
* inchi key:
−
** InChIKey=SENPVEZBRZQVST-HISDBWNOSA-L
+
** InChIKey=PEVZKILCBDEOBT-UHFFFAOYSA-J
 
* common name:
 
* common name:
−
** nicotinate adenine dinucleotide
+
** 3-hydroxyisovaleryl-CoA
 
* molecular weight:
 
* molecular weight:
−
** 662.399    
+
** 863.619    
 
* Synonym(s):
 
* Synonym(s):
−
** Deamino-NAD+
+
** 3-hydroxy-isovaleryl-coa
−
** NaADN
+
** 3-hydroxy-iso-valeryl-CoA
−
** deamido-NAD+
+
−
** deamidonicotinamide adenine dinucleoetide
+
−
** deamido-NAD
+
−
** NAAD
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[NAD-SYNTH-NH3-RXN]]
 
−
* [[NAD-SYNTH-GLN-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[NICONUCADENYLYLTRAN-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-14266]]
 
== External links  ==
 
== External links  ==
−
* CAS : 6450-77-7
 
−
* DRUGBANK : DB04099
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266646 45266646]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=25203667 25203667]
−
* HMDB : HMDB01179
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C00857 C00857]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58437 58437]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62555 62555]
−
* BIGG : 36219
+
{{#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(=O)CC(C)(C)O)=O)=O)O}}
−
{{#set: smiles=C(OP(=O)([O-])OP(=O)([O-])OCC2(C(O)C(C([N+]1(C=CC=C(C([O-])=O)C=1))O2)O))C3(C(O)C(O)C(O3)N5(C=NC4(C(N)=NC=NC=45)))}}
+
{{#set: inchi key=InChIKey=PEVZKILCBDEOBT-UHFFFAOYSA-J}}
−
{{#set: inchi key=InChIKey=SENPVEZBRZQVST-HISDBWNOSA-L}}
+
{{#set: common name=3-hydroxyisovaleryl-CoA}}
−
{{#set: common name=nicotinate adenine dinucleotide}}
+
{{#set: molecular weight=863.619   }}
−
{{#set: molecular weight=662.399   }}
+
{{#set: common name=3-hydroxy-isovaleryl-coa|3-hydroxy-iso-valeryl-CoA}}
−
{{#set: common name=Deamino-NAD+|NaADN|deamido-NAD+|deamidonicotinamide adenine dinucleoetide|deamido-NAD|NAAD}}
+
{{#set: reversible reaction associated=RXN-14266}}
−
{{#set: consumed by=NAD-SYNTH-NH3-RXN|NAD-SYNTH-GLN-RXN}}
+
−
{{#set: produced by=NICONUCADENYLYLTRAN-RXN}}
+

Latest revision as of 20:00, 21 March 2018

Metabolite 3-HYDROXY-ISOVALERYL-COA

  • 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(=O)CC(C)(C)O)=O)=O)O
  • inchi key:
    • InChIKey=PEVZKILCBDEOBT-UHFFFAOYSA-J
  • common name:
    • 3-hydroxyisovaleryl-CoA
  • molecular weight:
    • 863.619
  • Synonym(s):
    • 3-hydroxy-isovaleryl-coa
    • 3-hydroxy-iso-valeryl-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(=O)CC(C)(C)O)=O)=O)O" cannot be used as a page name in this wiki.



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