Difference between revisions of "CPD-17814"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIETHYLTHIOPHOSPHATE DIETHYLTHIOPHOSPHATE] == * smiles: ** CCOP(=S)([O-])OCC * common name: **...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17814 CPD-17814] == * smiles: ** CCCCC=CCCCCCCCC(CC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(OP(...")
 
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIETHYLTHIOPHOSPHATE DIETHYLTHIOPHOSPHATE] ==
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== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17814 CPD-17814] ==
 
* smiles:
 
* smiles:
** CCOP(=S)([O-])OCC
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** CCCCC=CCCCCCCCC(CC(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-])=O)O
 
* common name:
 
* common name:
** diethylthiophosphate
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** (11Z)-(S)-3-hydroxyhexadec-11-enoyl-CoA
 
* inchi key:
 
* inchi key:
** InChIKey=PKUWKAXTAVNIJR-UHFFFAOYSA-M
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** InChIKey=SHGDVNGLFXVIAK-BFVORPHASA-J
 
* molecular weight:
 
* molecular weight:
** 169.155    
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** 1015.898    
 
* Synonym(s):
 
* Synonym(s):
** DETP
 
** diethylthiophosphoric acid
 
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-16559]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[ARYLDIALKYL-PHOSPHATASE-RXN]]
 
* [[AMINOPARATHION-PHOSPHATASE-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
* CAS : 5871-17-0
 
 
* PUBCHEM:
 
* PUBCHEM:
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3683036 3683036]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=91820456 91820456]
* CHEMSPIDER:
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{{#set: smiles=CCCCC=CCCCCCCCC(CC(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-])=O)O}}
** [http://www.chemspider.com/Chemical-Structure.2915523.html 2915523]
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{{#set: common name=(11Z)-(S)-3-hydroxyhexadec-11-enoyl-CoA}}
* HMDB : HMDB01460
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{{#set: inchi key=InChIKey=SHGDVNGLFXVIAK-BFVORPHASA-J}}
* LIGAND-CPD:
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{{#set: molecular weight=1015.898   }}
** [http://www.genome.jp/dbget-bin/www_bget?C06607 C06607]
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{{#set: consumed by=RXN-16559}}
{{#set: smiles=CCOP(=S)([O-])OCC}}
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{{#set: common name=diethylthiophosphate}}
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{{#set: inchi key=InChIKey=PKUWKAXTAVNIJR-UHFFFAOYSA-M}}
+
{{#set: molecular weight=169.155   }}
+
{{#set: common name=DETP|diethylthiophosphoric acid}}
+
{{#set: produced by=ARYLDIALKYL-PHOSPHATASE-RXN|AMINOPARATHION-PHOSPHATASE-RXN}}
+

Latest revision as of 19:50, 21 March 2018

Metabolite CPD-17814

  • smiles:
    • CCCCC=CCCCCCCCC(CC(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-])=O)O
  • common name:
    • (11Z)-(S)-3-hydroxyhexadec-11-enoyl-CoA
  • inchi key:
    • InChIKey=SHGDVNGLFXVIAK-BFVORPHASA-J
  • molecular weight:
    • 1015.898
  • Synonym(s):

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCC=CCCCCCCCC(CC(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-])=O)O" cannot be used as a page name in this wiki.