Difference between revisions of "CPD-9898"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ARACHIDONIC_ACID ARACHIDONIC_ACID] == * smiles: ** CCCCCC=CCC=CCC=CCC=CCCCC(=O)[O-] * common na...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9898 CPD-9898] == * smiles: ** CC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=...")
Line 1: Line 1:
 
[[Category:Metabolite]]
 
[[Category:Metabolite]]
−
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ARACHIDONIC_ACID ARACHIDONIC_ACID] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-9898 CPD-9898] ==
 
* smiles:
 
* smiles:
−
** CCCCCC=CCC=CCC=CCC=CCCCC(=O)[O-]
+
** CC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=C(C(OC)=CC(C([O-])=O)=C1)O))C)C)C)C)C)C)C)C
−
* common name:
+
−
** arachidonate
+
 
* inchi key:
 
* inchi key:
−
** InChIKey=YZXBAPSDXZZRGB-DOFZRALJSA-M
+
** InChIKey=FDPPBYXDOXRDHA-JSGWLJPKSA-M
 +
* common name:
 +
** 3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate
 
* molecular weight:
 
* molecular weight:
−
** 303.464    
+
** 780.205    
 
* Synonym(s):
 
* Synonym(s):
−
** (5Z,8Z,11Z,14Z)-icosatetraenoate
+
** 3-methoxy-4-hydroxy-5-nonaprenylbenzoate
−
** arachidonic acid
+
** 3-(3,7,11,15,19,23-nonamethyltetracosa-2,6,10,14,18,22-hexaenyl) -4-hydroxy-5-methoxy-benzoic acid
−
** all-cis-icosa-5,8,11,14-tetraenoate
+
** 3-nonaprenyl-4-hydroxy-5-methoxybenzoate
−
** (5Z,8Z,11Z,14Z)-icosatetra-5,8,11,14-enoate
+
  
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
−
* [[RXN-16016]]
+
* [[RXN-9281]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
* CAS : 506-32-1
 
−
* Wikipedia : Arachidonic_acid
 
 
* PUBCHEM:
 
* PUBCHEM:
−
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460265 5460265]
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=54738025 54738025]
−
* HMDB : HMDB01043
+
−
* LIGAND-CPD:
+
−
** [http://www.genome.jp/dbget-bin/www_bget?C00219 C00219]
+
−
* CHEMSPIDER:
+
−
** [http://www.chemspider.com/Chemical-Structure.4573863.html 4573863]
+
 
* CHEBI:
 
* CHEBI:
−
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=32395 32395]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=62791 62791]
−
* METABOLIGHTS : MTBLC32395
+
{{#set: smiles=CC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=C(C(OC)=CC(C([O-])=O)=C1)O))C)C)C)C)C)C)C)C}}
−
{{#set: smiles=CCCCCC=CCC=CCC=CCC=CCCCC(=O)[O-]}}
+
{{#set: inchi key=InChIKey=FDPPBYXDOXRDHA-JSGWLJPKSA-M}}
−
{{#set: common name=arachidonate}}
+
{{#set: common name=3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate}}
−
{{#set: inchi key=InChIKey=YZXBAPSDXZZRGB-DOFZRALJSA-M}}
+
{{#set: molecular weight=780.205   }}
−
{{#set: molecular weight=303.464   }}
+
{{#set: common name=3-methoxy-4-hydroxy-5-nonaprenylbenzoate|3-(3,7,11,15,19,23-nonamethyltetracosa-2,6,10,14,18,22-hexaenyl) -4-hydroxy-5-methoxy-benzoic acid|3-nonaprenyl-4-hydroxy-5-methoxybenzoate}}
−
{{#set: common name=(5Z,8Z,11Z,14Z)-icosatetraenoate|arachidonic acid|all-cis-icosa-5,8,11,14-tetraenoate|(5Z,8Z,11Z,14Z)-icosatetra-5,8,11,14-enoate}}
+
{{#set: produced by=RXN-9281}}
−
{{#set: produced by=RXN-16016}}
+

Revision as of 17:23, 23 May 2018

Metabolite CPD-9898

  • smiles:
    • CC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=C(C(OC)=CC(C([O-])=O)=C1)O))C)C)C)C)C)C)C)C
  • inchi key:
    • InChIKey=FDPPBYXDOXRDHA-JSGWLJPKSA-M
  • common name:
    • 3-methoxy-4-hydroxy-5-all-trans-nonaprenylbenzoate
  • molecular weight:
    • 780.205
  • Synonym(s):
    • 3-methoxy-4-hydroxy-5-nonaprenylbenzoate
    • 3-(3,7,11,15,19,23-nonamethyltetracosa-2,6,10,14,18,22-hexaenyl) -4-hydroxy-5-methoxy-benzoic acid
    • 3-nonaprenyl-4-hydroxy-5-methoxybenzoate

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

"CC(C)=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1(=C(C(OC)=CC(C([O-])=O)=C1)O))C)C)C)C)C)C)C)C" cannot be used as a page name in this wiki.



Retrieved from "http://gem-aureme.irisa.fr/ccrgem/index.php?title=CPD-9898&oldid=16959"