Difference between revisions of "OLEATE-CPD"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN66-476-CPD-14719/NAD/WATER//CPD-7830/NADH/PROTON.42. RXN66-476-CPD-14719/NAD/WATER//CPD-7830/NAD...")
 
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=OLEATE-CPD OLEATE-CPD] == * smiles: ** CCCCCCCCC=CCCCCCCCC([O-])=O * common name: ** oleate * i...")
 
(3 intermediate revisions by the same user not shown)
Line 1: Line 1:
−
[[Category:Reaction]]
+
[[Category:Metabolite]]
−
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN66-476-CPD-14719/NAD/WATER//CPD-7830/NADH/PROTON.42. RXN66-476-CPD-14719/NAD/WATER//CPD-7830/NADH/PROTON.42.] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=OLEATE-CPD OLEATE-CPD] ==
−
* direction:
+
* smiles:
−
** LEFT-TO-RIGHT
+
** CCCCCCCCC=CCCCCCCCC([O-])=O
 +
* common name:
 +
** oleate
 +
* inchi key:
 +
** InChIKey=ZQPPMHVWECSIRJ-KTKRTIGZSA-M
 +
* molecular weight:
 +
** 281.457   
 
* Synonym(s):
 
* Synonym(s):
 +
** oleic acid
 +
** (9Z)-octadec-9-enoate
 +
** (9Z)-octadecenoate
 +
** (9Z)-octadecenoic acid
 +
** (9Z)-octadec-9-enoic acid
 +
** (Z)-octadec-9-enoic acid
 +
** 18:1 n-9
 +
** 18:1Δ9cis
 +
** C18:1 n-9
 +
** cis-9-octadecenoic acid
 +
** cis-Δ9-octadecenoic acid
 +
** cis-oleic acid
 +
** octadec-9-enoic acid
 +
** octadecenoate (n-C18:1)
 +
** 9-octadecenoic acid
  
−
== Reaction Formula ==
+
== Reaction(s) known to consume the compound ==
−
* With identifiers:
+
* [[RXN-9644]]
−
** 1.0 [[CPD-14719]][c] '''+''' 1.0 [[WATER]][c] '''+''' 1.0 [[NAD]][c] '''=>''' 2.0 [[PROTON]][c] '''+''' 1.0 [[NADH]][c] '''+''' 1.0 [[CPD-7830]][c]
+
* [[RXN0-7239]]
−
* With common name(s):
+
* [[RXN-12776]]
−
** 1.0 heptadecanal[c] '''+''' 1.0 H2O[c] '''+''' 1.0 NAD+[c] '''=>''' 2.0 H+[c] '''+''' 1.0 NADH[c] '''+''' 1.0 heptadecanoate[c]
+
* [[FACOAL18111Z]]
−
 
+
== Reaction(s) known to produce the compound ==
−
== Genes associated with this reaction  ==
+
* [[3.1.2.14-RXN]]
−
== Pathways  ==
+
* [[RXN-9666]]
−
== Reconstruction information  ==
+
* [[RXN-15068]]
−
* [[gap-filling]]:
+
* [[RXN-15088]]
−
** [[meneco]]:
+
* [[RXN-15067]]
−
*** [[added for gapfilling]]
+
* [[RXN-15035]]
 +
* [[RXN-15089]]
 +
== Reaction(s) of unknown directionality ==
 
== External links  ==
 
== External links  ==
−
{{#set: direction=LEFT-TO-RIGHT}}
+
* CAS : 112-80-1
−
{{#set: in pathway=}}
+
* BIGG : ocdcea
−
{{#set: reconstruction category=gap-filling}}
+
* PUBCHEM:
−
{{#set: reconstruction tool=meneco}}
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5460221 5460221]
−
{{#set: reconstruction source=added for gapfilling}}
+
* HMDB : HMDB00207
 +
* LIGAND-CPD:
 +
** [http://www.genome.jp/dbget-bin/www_bget?C00712 C00712]
 +
* CHEMSPIDER:
 +
** [http://www.chemspider.com/Chemical-Structure.4573837.html 4573837]
 +
* CHEBI:
 +
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=30823 30823]
 +
* METABOLIGHTS : MTBLC30823
 +
{{#set: smiles=CCCCCCCCC=CCCCCCCCC([O-])=O}}
 +
{{#set: common name=oleate}}
 +
{{#set: inchi key=InChIKey=ZQPPMHVWECSIRJ-KTKRTIGZSA-M}}
 +
{{#set: molecular weight=281.457    }}
 +
{{#set: common name=oleic acid|(9Z)-octadec-9-enoate|(9Z)-octadecenoate|(9Z)-octadecenoic acid|(9Z)-octadec-9-enoic acid|(Z)-octadec-9-enoic acid|18:1 n-9|18:1Δ9cis|C18:1 n-9|cis-9-octadecenoic acid|cis-Δ9-octadecenoic acid|cis-oleic acid|octadec-9-enoic acid|octadecenoate (n-C18:1)|9-octadecenoic acid}}
 +
{{#set: consumed by=RXN-9644|RXN0-7239|RXN-12776|FACOAL18111Z}}
 +
{{#set: produced by=3.1.2.14-RXN|RXN-9666|RXN-15068|RXN-15088|RXN-15067|RXN-15035|RXN-15089}}

Latest revision as of 20:54, 21 March 2018

Metabolite OLEATE-CPD

  • smiles:
    • CCCCCCCCC=CCCCCCCCC([O-])=O
  • common name:
    • oleate
  • inchi key:
    • InChIKey=ZQPPMHVWECSIRJ-KTKRTIGZSA-M
  • molecular weight:
    • 281.457
  • Synonym(s):
    • oleic acid
    • (9Z)-octadec-9-enoate
    • (9Z)-octadecenoate
    • (9Z)-octadecenoic acid
    • (9Z)-octadec-9-enoic acid
    • (Z)-octadec-9-enoic acid
    • 18:1 n-9
    • 18:1Δ9cis
    • C18:1 n-9
    • cis-9-octadecenoic acid
    • cis-Δ9-octadecenoic acid
    • cis-oleic acid
    • octadec-9-enoic acid
    • octadecenoate (n-C18:1)
    • 9-octadecenoic acid

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 112-80-1
  • BIGG : ocdcea
  • PUBCHEM:
  • HMDB : HMDB00207
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC30823
"CCCCCCCCC=CCCCCCCCC([O-])=O" cannot be used as a page name in this wiki.




Retrieved from "http://gem-aureme.irisa.fr/tisogem/index.php?title=OLEATE-CPD&oldid=44573"