Difference between revisions of "PWY-6908"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIETHYLTHIOPHOSPHATE DIETHYLTHIOPHOSPHATE] == * smiles: ** CCOP(=S)([O-])OCC * inchi key: ** In...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10277 CPD-10277] == * smiles: ** CCC(OC1(OC(CO)C(O)C(O)C(O)1))(C#N)C * common name: ** lota...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=DIETHYLTHIOPHOSPHATE DIETHYLTHIOPHOSPHATE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-10277 CPD-10277] ==
 
* smiles:
 
* smiles:
** CCOP(=S)([O-])OCC
+
** CCC(OC1(OC(CO)C(O)C(O)C(O)1))(C#N)C
* inchi key:
+
** InChIKey=PKUWKAXTAVNIJR-UHFFFAOYSA-M
+
 
* common name:
 
* common name:
** diethylthiophosphate
+
** lotaustralin
 +
* inchi key:
 +
** InChIKey=WEWBWVMTOYUPHH-QHAQEBJBSA-N
 
* molecular weight:
 
* molecular weight:
** 169.155    
+
** 261.274    
 
* Synonym(s):
 
* Synonym(s):
** DETP
+
** 2-hydroxy-2-methylbutyronitrile-beta-D-glucopyranoside
** diethylthiophosphoric acid
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-9674]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[ARYLDIALKYL-PHOSPHATASE-RXN]]
+
* [[RXN-13603]]
* [[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]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=441467 441467]
* CHEMSPIDER:
+
* HMDB : HMDB33865
** [http://www.chemspider.com/Chemical-Structure.2915523.html 2915523]
+
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=6542 6542]
 
* LIGAND-CPD:
 
* LIGAND-CPD:
** [http://www.genome.jp/dbget-bin/www_bget?C06607 C06607]
+
** [http://www.genome.jp/dbget-bin/www_bget?C08334 C08334]
* HMDB : HMDB01460
+
{{#set: smiles=CCC(OC1(OC(CO)C(O)C(O)C(O)1))(C#N)C}}
{{#set: smiles=CCOP(=S)([O-])OCC}}
+
{{#set: common name=lotaustralin}}
{{#set: inchi key=InChIKey=PKUWKAXTAVNIJR-UHFFFAOYSA-M}}
+
{{#set: inchi key=InChIKey=WEWBWVMTOYUPHH-QHAQEBJBSA-N}}
{{#set: common name=diethylthiophosphate}}
+
{{#set: molecular weight=261.274   }}
{{#set: molecular weight=169.155   }}
+
{{#set: common name=2-hydroxy-2-methylbutyronitrile-beta-D-glucopyranoside}}
{{#set: common name=DETP|diethylthiophosphoric acid}}
+
{{#set: consumed by=RXN-9674}}
{{#set: produced by=ARYLDIALKYL-PHOSPHATASE-RXN|AMINOPARATHION-PHOSPHATASE-RXN}}
+
{{#set: produced by=RXN-13603}}

Revision as of 16:30, 21 March 2018

Metabolite CPD-10277

  • smiles:
    • CCC(OC1(OC(CO)C(O)C(O)C(O)1))(C#N)C
  • common name:
    • lotaustralin
  • inchi key:
    • InChIKey=WEWBWVMTOYUPHH-QHAQEBJBSA-N
  • molecular weight:
    • 261.274
  • Synonym(s):
    • 2-hydroxy-2-methylbutyronitrile-beta-D-glucopyranoside

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links