Difference between revisions of "CPD-18353"

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(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ALLYSINE ALLYSINE] == * smiles: ** [CH](=O)CCCC([N+])C(=O)[O-] * inchi key: ** InChIKey=GFXYTQP...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18353 CPD-18353] == * smiles: ** CCCCCCC=CCCCCCCCCCC(OCC(OC(=O)CCCCCCCCCC=CCCCCCC)COP([O-])...")
 
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ALLYSINE ALLYSINE] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-18353 CPD-18353] ==
 
* smiles:
 
* smiles:
−
** [CH](=O)CCCC([N+])C(=O)[O-]
+
** CCCCCCC=CCCCCCCCCCC(OCC(OC(=O)CCCCCCCCCC=CCCCCCC)COP([O-])(=O)[O-])=O
 
* inchi key:
 
* inchi key:
−
** InChIKey=GFXYTQPNNXGICT-YFKPBYRVSA-N
+
** InChIKey=LMYYBYHAZAFVTR-YKEOXISKSA-L
 
* common name:
 
* common name:
−
** (S)-2-amino-6-oxohexanoate
+
** 1,2-dicis-vaccenoyl-phosphatidate
 
* molecular weight:
 
* molecular weight:
−
** 145.158    
+
** 698.959    
 
* Synonym(s):
 
* Synonym(s):
−
** allysine
+
** 18:1-18:1-PA
−
** L-2-aminoadipate 6-semialdehyde
+
** 1,2-(11Z-octadecenoyl)-sn-glycerol-3-phosphate
−
** 2-aminoadipate 6-semialdehyde
+
** 1,2-dicis-vaccenoyl phosphatidate
−
** α-aminoadipate 6-semialdehyde
+
−
** 2-aminoadipate semialdehyde
+
−
** L-allysine
+
−
** (S)-2-aminoadipate 6-semialdehyde
+
−
** 2-aminoadipate-6-semialdehyde
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
−
* [[1.2.1.31-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[1.5.1.9-RXN]]
+
* [[RXN-17011]]
 +
* [[RXN-17015]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
−
* [[RXN-8173]]
 
 
== External links  ==
 
== External links  ==
−
* CAS : 1962-83-0
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{{#set: smiles=CCCCCCC=CCCCCCCCCCC(OCC(OC(=O)CCCCCCCCCC=CCCCCCC)COP([O-])(=O)[O-])=O}}
−
* PUBCHEM:
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{{#set: inchi key=InChIKey=LMYYBYHAZAFVTR-YKEOXISKSA-L}}
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=36688062 36688062]
+
{{#set: common name=1,2-dicis-vaccenoyl-phosphatidate}}
−
* HMDB : HMDB59595
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{{#set: molecular weight=698.959   }}
−
* LIGAND-CPD:
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{{#set: common name=18:1-18:1-PA|1,2-(11Z-octadecenoyl)-sn-glycerol-3-phosphate|1,2-dicis-vaccenoyl phosphatidate}}
−
** [http://www.genome.jp/dbget-bin/www_bget?C04076 C04076]
+
{{#set: produced by=RXN-17011|RXN-17015}}
−
* CHEBI:
+
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=58321 58321]
+
−
* METABOLIGHTS : MTBLC58321
+
−
{{#set: smiles=[CH](=O)CCCC([N+])C(=O)[O-]}}
+
−
{{#set: inchi key=InChIKey=GFXYTQPNNXGICT-YFKPBYRVSA-N}}
+
−
{{#set: common name=(S)-2-amino-6-oxohexanoate}}
+
−
{{#set: molecular weight=145.158   }}
+
−
{{#set: common name=allysine|L-2-aminoadipate 6-semialdehyde|2-aminoadipate 6-semialdehyde|α-aminoadipate 6-semialdehyde|2-aminoadipate semialdehyde|L-allysine|(S)-2-aminoadipate 6-semialdehyde|2-aminoadipate-6-semialdehyde}}
+
−
{{#set: consumed by=1.2.1.31-RXN}}
+
−
{{#set: produced by=1.5.1.9-RXN}}
+
−
{{#set: reversible reaction associated=RXN-8173}}
+

Latest revision as of 19:21, 21 March 2018

Metabolite CPD-18353

  • smiles:
    • CCCCCCC=CCCCCCCCCCC(OCC(OC(=O)CCCCCCCCCC=CCCCCCC)COP([O-])(=O)[O-])=O
  • inchi key:
    • InChIKey=LMYYBYHAZAFVTR-YKEOXISKSA-L
  • common name:
    • 1,2-dicis-vaccenoyl-phosphatidate
  • molecular weight:
    • 698.959
  • Synonym(s):
    • 18:1-18:1-PA
    • 1,2-(11Z-octadecenoyl)-sn-glycerol-3-phosphate
    • 1,2-dicis-vaccenoyl phosphatidate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

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



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