Difference between revisions of "CPD-8291"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=P3I P3I] == * smiles: ** [O-]P(OP(=O)(OP([O-])(=O)[O-])[O-])([O-])=O * inchi key: ** InChIKey=U...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8291 CPD-8291] == * smiles: ** CCCCCCCCC=CCCCCCCCC(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(OCC[N+]...")
 
(One intermediate revision by the same user not shown)
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[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=P3I P3I] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8291 CPD-8291] ==
 
* smiles:
 
* smiles:
−
** [O-]P(OP(=O)(OP([O-])(=O)[O-])[O-])([O-])=O
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** CCCCCCCCC=CCCCCCCCC(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(OCC[N+])([O-])=O)=O
 
* inchi key:
 
* inchi key:
−
** InChIKey=UNXRWKVEANCORM-UHFFFAOYSA-I
+
** InChIKey=MWRBNPKJOOWZPW-NYVOMTAGSA-N
 
* common name:
 
* common name:
−
** PPPi
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** 1-18:1-2-18:1-phosphatidylethanolamine
 
* molecular weight:
 
* molecular weight:
−
** 252.915    
+
** 744.043    
 
* Synonym(s):
 
* Synonym(s):
−
** inorganic triphosphate
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** phosphatidylethanolamine (1-18:1-2-18:1)
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** tripolyphosphate
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** 18:1-18:1-PE
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** triphosphate
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** 1,2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine
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** inorganic open chain tripolyphosphate
+
−
** P3,i
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-15067]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[BTUR2-RXN]]
 
−
* [[R344-RXN]]
 
−
* [[4.2.3.12-RXN]]
 
−
* [[COBALADENOSYLTRANS-RXN]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 +
* [[RXN-15036]]
 
== External links  ==
 
== External links  ==
−
* CAS : 14127-68-5
 
−
* BIGG : 41547
 
 
* PUBCHEM:
 
* PUBCHEM:
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=3440921 3440921]
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** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44251425 44251425]
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* HMDB : HMDB03379
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−
* LIGAND-CPD:
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** [http://www.genome.jp/dbget-bin/www_bget?C00536 C00536]
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−
* CHEMSPIDER:
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** [http://www.chemspider.com/Chemical-Structure.2683694.html 2683694]
+
 
* CHEBI:
 
* CHEBI:
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=18036 18036]
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** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=74986 74986]
−
* METABOLIGHTS : MTBLC18036
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{{#set: smiles=CCCCCCCCC=CCCCCCCCC(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(OCC[N+])([O-])=O)=O}}
−
{{#set: smiles=[O-]P(OP(=O)(OP([O-])(=O)[O-])[O-])([O-])=O}}
+
{{#set: inchi key=InChIKey=MWRBNPKJOOWZPW-NYVOMTAGSA-N}}
−
{{#set: inchi key=InChIKey=UNXRWKVEANCORM-UHFFFAOYSA-I}}
+
{{#set: common name=1-18:1-2-18:1-phosphatidylethanolamine}}
−
{{#set: common name=PPPi}}
+
{{#set: molecular weight=744.043   }}
−
{{#set: molecular weight=252.915   }}
+
{{#set: common name=phosphatidylethanolamine (1-18:1-2-18:1)|18:1-18:1-PE|1,2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine}}
−
{{#set: common name=inorganic triphosphate|tripolyphosphate|triphosphate|inorganic open chain tripolyphosphate|P3,i}}
+
{{#set: consumed by=RXN-15067}}
−
{{#set: produced by=BTUR2-RXN|R344-RXN|4.2.3.12-RXN|COBALADENOSYLTRANS-RXN}}
+
{{#set: reversible reaction associated=RXN-15036}}

Latest revision as of 20:38, 21 March 2018

Metabolite CPD-8291

  • smiles:
    • CCCCCCCCC=CCCCCCCCC(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(OCC[N+])([O-])=O)=O
  • inchi key:
    • InChIKey=MWRBNPKJOOWZPW-NYVOMTAGSA-N
  • common name:
    • 1-18:1-2-18:1-phosphatidylethanolamine
  • molecular weight:
    • 744.043
  • Synonym(s):
    • phosphatidylethanolamine (1-18:1-2-18:1)
    • 18:1-18:1-PE
    • 1,2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CCCCCCCCC=CCCCCCCCC(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COP(OCC[N+])([O-])=O)=O" cannot be used as a page name in this wiki.




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