Difference between revisions of "PHOSPHORYL-CHOLINE"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HYDROXY-METHYL-BUTENYL-DIP HYDROXY-METHYL-BUTENYL-DIP] == * smiles: ** CC(CO)=CCOP(OP([O-])(=O)...")
 
 
(One intermediate revision by the same user not shown)
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=HYDROXY-METHYL-BUTENYL-DIP HYDROXY-METHYL-BUTENYL-DIP] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PHOSPHORYL-CHOLINE PHOSPHORYL-CHOLINE] ==
 
* smiles:
 
* smiles:
−
** CC(CO)=CCOP(OP([O-])(=O)[O-])(=O)[O-]
+
** C[N+](CCOP([O-])([O-])=O)(C)C
 +
* molecular weight:
 +
** 182.136   
 
* inchi key:
 
* inchi key:
−
** InChIKey=MDSIZRKJVDMQOQ-GORDUTHDSA-K
+
** InChIKey=YHHSONZFOIEMCP-UHFFFAOYSA-M
 
* common name:
 
* common name:
−
** (E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate
+
** phosphocholine
−
* molecular weight:
+
−
** 259.069   
+
 
* Synonym(s):
 
* Synonym(s):
−
** (E)-4-hydroxy-3-methylbut 2-en-1-yl diphosphate
+
** choline-phosphate
−
** HMBDP
+
** phosphoryl-choline
−
** 1-hydroxy-2-methyl-2-(E)-butenyl 4-diphosphate
+
** O-phosphocholine
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[ISPH2-RXN]]
 
−
* [[RXN0-884]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN0-882]]
+
* [[CHOLINE-KINASE-RXN]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* PUBCHEM:
+
* METABOLIGHTS : MTBLC295975
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=21597501 21597501]
+
* CAS : 107-73-3
 +
* HMDB : HMDB01565
 
* CHEMSPIDER:
 
* CHEMSPIDER:
−
** [http://www.chemspider.com/Chemical-Structure.10224038.html 10224038]
+
** [http://www.chemspider.com/Chemical-Structure.2578067.html 2578067]
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=128753 128753]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=295975 295975]
−
* BIGG : h2mb4p
+
 
* LIGAND-CPD:
 
* LIGAND-CPD:
−
** [http://www.genome.jp/dbget-bin/www_bget?C11811 C11811]
+
** [http://www.genome.jp/dbget-bin/www_bget?C00588 C00588]
−
{{#set: smiles=CC(CO)=CCOP(OP([O-])(=O)[O-])(=O)[O-]}}
+
* PUBCHEM:
−
{{#set: inchi key=InChIKey=MDSIZRKJVDMQOQ-GORDUTHDSA-K}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3330960 3330960]
−
{{#set: common name=(E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate}}
+
{{#set: smiles=C[N+](CCOP([O-])([O-])=O)(C)C}}
−
{{#set: molecular weight=259.069    }}
+
{{#set: molecular weight=182.136    }}
−
{{#set: common name=(E)-4-hydroxy-3-methylbut 2-en-1-yl diphosphate|HMBDP|1-hydroxy-2-methyl-2-(E)-butenyl 4-diphosphate}}
+
{{#set: inchi key=InChIKey=YHHSONZFOIEMCP-UHFFFAOYSA-M}}
−
{{#set: consumed by=ISPH2-RXN|RXN0-884}}
+
{{#set: common name=phosphocholine}}
−
{{#set: produced by=RXN0-882}}
+
{{#set: common name=choline-phosphate|phosphoryl-choline|O-phosphocholine}}
 +
{{#set: produced by=CHOLINE-KINASE-RXN}}

Latest revision as of 18:51, 9 January 2019

Metabolite PHOSPHORYL-CHOLINE

  • smiles:
    • C[N+](CCOP([O-])([O-])=O)(C)C
  • molecular weight:
    • 182.136
  • inchi key:
    • InChIKey=YHHSONZFOIEMCP-UHFFFAOYSA-M
  • common name:
    • phosphocholine
  • Synonym(s):
    • choline-phosphate
    • phosphoryl-choline
    • O-phosphocholine

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • METABOLIGHTS : MTBLC295975
  • CAS : 107-73-3
  • HMDB : HMDB01565
  • CHEMSPIDER:
  • CHEBI:
  • LIGAND-CPD:
  • PUBCHEM:
"C[N+](CCOP([O-])([O-])=O)(C)C" cannot be used as a page name in this wiki.



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