Difference between revisions of "CPD-8974"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DADP DADP] == * smiles: ** C(C3(C(CC(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O))OP(OP([O-])([O-])=O)([O-]...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8974 CPD-8974] == * smiles: ** COP([O-])(=S)OC * inchi key: ** InChIKey=WWJJVKAEQGGYHJ-UHFF...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DADP DADP] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8974 CPD-8974] ==
 
* smiles:
 
* smiles:
** C(C3(C(CC(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O))OP(OP([O-])([O-])=O)([O-])=O
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** COP([O-])(=S)OC
 
* inchi key:
 
* inchi key:
** InChIKey=DAEAPNUQQAICNR-RRKCRQDMSA-K
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** InChIKey=WWJJVKAEQGGYHJ-UHFFFAOYSA-M
 
* common name:
 
* common name:
** dADP
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** dimethylthiophosphate
 
* molecular weight:
 
* molecular weight:
** 408.18    
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** 141.101    
 
* Synonym(s):
 
* Synonym(s):
** 2'-deoxyadenosine-5'-diphosphate
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** O,O-dimethylthiophosphate
** deoxyadenosine-diphosphate
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** O,O-dimethyl phosphorothionate
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[DADPKIN-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-14214]]
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* [[RXN-8743]]
* [[RXN0-747]]
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== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
* [[ADPREDUCT-RXN]]
 
* [[RXN-14215]]
 
* [[RXN-14192]]
 
 
== External links  ==
 
== External links  ==
* CAS : 2793-06-8
 
* BIGG : 34254
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=21125569 21125569]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3539116 3539116]
* HMDB : HMDB01508
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* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C00206 C00206]
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* CHEMSPIDER:
 
* CHEMSPIDER:
** [http://www.chemspider.com/Chemical-Structure.19992628.html 19992628]
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** [http://www.chemspider.com/Chemical-Structure.2777580.html 2777580]
* CHEBI:
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{{#set: smiles=COP([O-])(=S)OC}}
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=57667 57667]
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{{#set: inchi key=InChIKey=WWJJVKAEQGGYHJ-UHFFFAOYSA-M}}
* METABOLIGHTS : MTBLC57667
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{{#set: common name=dimethylthiophosphate}}
{{#set: smiles=C(C3(C(CC(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O))OP(OP([O-])([O-])=O)([O-])=O}}
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{{#set: molecular weight=141.101   }}
{{#set: inchi key=InChIKey=DAEAPNUQQAICNR-RRKCRQDMSA-K}}
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{{#set: common name=O,O-dimethylthiophosphate|O,O-dimethyl phosphorothionate}}
{{#set: common name=dADP}}
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{{#set: produced by=RXN-8743}}
{{#set: molecular weight=408.18   }}
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{{#set: common name=2'-deoxyadenosine-5'-diphosphate|deoxyadenosine-diphosphate}}
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{{#set: consumed by=DADPKIN-RXN}}
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{{#set: produced by=RXN-14214|RXN0-747}}
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{{#set: reversible reaction associated=ADPREDUCT-RXN|RXN-14215|RXN-14192}}
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Latest revision as of 19:03, 21 March 2018

Metabolite CPD-8974

  • smiles:
    • COP([O-])(=S)OC
  • inchi key:
    • InChIKey=WWJJVKAEQGGYHJ-UHFFFAOYSA-M
  • common name:
    • dimethylthiophosphate
  • molecular weight:
    • 141.101
  • Synonym(s):
    • O,O-dimethylthiophosphate
    • O,O-dimethyl phosphorothionate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"COP([O-])(=S)OC" cannot be used as a page name in this wiki.