Difference between revisions of "DEAMIDO-NAD"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15125 CPD-15125] == * smiles: ** C(=O)([O-])CCC(O)C=C(O)C(=O)[O-] * inchi key: ** InChIKey=...")
(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(...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-15125 CPD-15125] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DEAMIDO-NAD DEAMIDO-NAD] ==
 
* smiles:
 
* smiles:
** C(=O)([O-])CCC(O)C=C(O)C(=O)[O-]
+
** 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)))
 
* inchi key:
 
* inchi key:
** InChIKey=APNIDHDQYISZAE-HYXAFXHYSA-L
+
** InChIKey=SENPVEZBRZQVST-HISDBWNOSA-L
 
* common name:
 
* common name:
** 2,4-dihydroxyhept-2-enedioate
+
** nicotinate adenine dinucleotide
 
* molecular weight:
 
* molecular weight:
** 188.137    
+
** 662.399    
 
* Synonym(s):
 
* Synonym(s):
 +
** Deamino-NAD+
 +
** NaADN
 +
** 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-14146]]
 
 
== External links  ==
 
== External links  ==
 +
* CAS : 6450-77-7
 +
* DRUGBANK : DB04099
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54724344 54724344]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=45266646 45266646]
 +
* 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=58936 58936]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58437 58437]
{{#set: smiles=C(=O)([O-])CCC(O)C=C(O)C(=O)[O-]}}
+
* BIGG : 36219
{{#set: inchi key=InChIKey=APNIDHDQYISZAE-HYXAFXHYSA-L}}
+
{{#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: common name=2,4-dihydroxyhept-2-enedioate}}
+
{{#set: inchi key=InChIKey=SENPVEZBRZQVST-HISDBWNOSA-L}}
{{#set: molecular weight=188.137   }}
+
{{#set: common name=nicotinate adenine dinucleotide}}
{{#set: reversible reaction associated=RXN-14146}}
+
{{#set: molecular weight=662.399   }}
 +
{{#set: common name=Deamino-NAD+|NaADN|deamido-NAD+|deamidonicotinamide adenine dinucleoetide|deamido-NAD|NAAD}}
 +
{{#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 DEAMIDO-NAD

  • 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)))
  • inchi key:
    • InChIKey=SENPVEZBRZQVST-HISDBWNOSA-L
  • common name:
    • nicotinate adenine dinucleotide
  • molecular weight:
    • 662.399
  • Synonym(s):
    • Deamino-NAD+
    • NaADN
    • deamido-NAD+
    • deamidonicotinamide adenine dinucleoetide
    • deamido-NAD
    • NAAD

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 6450-77-7
  • DRUGBANK : DB04099
  • PUBCHEM:
  • HMDB : HMDB01179
  • LIGAND-CPD:
  • CHEBI:
  • BIGG : 36219
"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)))" cannot be used as a page name in this wiki.