Difference between revisions of "EPOXYSQUALENE"

From metabolic_network
Jump to: navigation, search
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=UGD-RXN UGD-RXN] == * direction: ** LEFT-TO-RIGHT * common name: ** UDP-glucose 6-dehydrogenase * e...")
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=EPOXYSQUALENE EPOXYSQUALENE] == * smiles: ** CC(C)=CCCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CC[CH]1(C(C...")
 
Line 1: Line 1:
[[Category:Reaction]]
+
[[Category:Metabolite]]
== Reaction [http://metacyc.org/META/NEW-IMAGE?object=UGD-RXN UGD-RXN] ==
+
== Metabolite [http://metacyc.org/META/NEW-IMAGE?object=EPOXYSQUALENE EPOXYSQUALENE] ==
* direction:
+
* smiles:
** LEFT-TO-RIGHT
+
** CC(C)=CCCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CC[CH]1(C(C)(C)O1)
 +
* inchi key:
 +
** InChIKey=QYIMSPSDBYKPPY-RSKUXYSASA-N
 
* common name:
 
* common name:
** UDP-glucose 6-dehydrogenase
+
** (3S)-2,3-epoxy-2,3-dihydrosqualene
* ec number:
+
* molecular weight:
** [http://enzyme.expasy.org/EC/1.1.1.22 EC-1.1.1.22]
+
** 426.724   
 
* Synonym(s):
 
* Synonym(s):
 +
** squalene 2,3-epoxide
 +
** squalene 2,3-oxide
 +
** (S)-squalene-2,3-epoxide
 +
** 2,3-EDSQ
 +
** 2,3-epoxisqualene
 +
** oxidosqualene
 +
** 2,3-oxidosqualene
 +
** (3S)-2,3-epoxysqualene
  
== Reaction Formula ==
+
== Reaction(s) known to consume the compound ==
* With identifiers:
+
* [[CYCLOARTENOL-SYNTHASE-RXN]]
** 1 [[WATER]][c] '''+''' 2 [[NAD]][c] '''+''' 1 [[CPD-12575]][c] '''=>''' 2 [[NADH]][c] '''+''' 1 [[UDP-GLUCURONATE]][c] '''+''' 3 [[PROTON]][c]
+
== Reaction(s) known to produce the compound ==
* With common name(s):
+
* [[SQUALENE-MONOOXYGENASE-RXN]]
** 1 H2O[c] '''+''' 2 NAD+[c] '''+''' 1 UDP-α-D-glucose[c] '''=>''' 2 NADH[c] '''+''' 1 UDP-α-D-glucuronate[c] '''+''' 3 H+[c]
+
== Reaction(s) of unknown directionality ==
 
+
== Genes associated with this reaction  ==
+
Genes have been associated with this reaction based on different elements listed below.
+
* Gene: [[Ec-04_001130]]
+
** Source: [[annotation-esiliculosus_genome]]
+
*** Assignment: EC-NUMBER
+
** Source: [[orthology-aragem]]
+
== Pathways  ==
+
* [[PWY-7346]], UDP-α-D-glucuronate biosynthesis (from UDP-glucose): [http://metacyc.org/META/NEW-IMAGE?object=PWY-7346 PWY-7346]
+
** '''1''' reactions found over '''1''' reactions in the full pathway
+
== Reconstruction information  ==
+
* Category: [[orthology]]
+
** Source: [[orthology-aragem]]
+
*** Tool: [[pantograph]]
+
* Category: [[annotation]]
+
** Source: [[annotation-esiliculosus_genome]]
+
*** Tool: [[pathwaytools]]
+
 
== External links  ==
 
== External links  ==
* RHEA:
+
* CAS : 9029-62-3
** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=23596 23596]
+
* PUBCHEM:
* LIGAND-RXN:
+
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5459811 5459811]
** [http://www.genome.jp/dbget-bin/www_bget?R00286 R00286]
+
* HMDB : HMDB01188
* UNIPROT:
+
* LIGAND-CPD:
** [http://www.uniprot.org/uniprot/Q8NKX0 Q8NKX0]
+
** [http://www.genome.jp/dbget-bin/www_bget?C01054 C01054]
** [http://www.uniprot.org/uniprot/Q9PML6 Q9PML6]
+
* CHEMSPIDER:
** [http://www.uniprot.org/uniprot/Q58454 Q58454]
+
** [http://www.chemspider.com/Chemical-Structure.4444080.html 4444080]
** [http://www.uniprot.org/uniprot/Q47329 Q47329]
+
* CHEBI:
** [http://www.uniprot.org/uniprot/Q96558 Q96558]
+
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=15441 15441]
** [http://www.uniprot.org/uniprot/O41091 O41091]
+
* METABOLIGHTS : MTBLC15441
** [http://www.uniprot.org/uniprot/Q9RMC2 Q9RMC2]
+
{{#set: smiles=CC(C)=CCCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CC[CH]1(C(C)(C)O1)}}
** [http://www.uniprot.org/uniprot/O54068 O54068]
+
{{#set: inchi key=InChIKey=QYIMSPSDBYKPPY-RSKUXYSASA-N}}
{{#set: direction=LEFT-TO-RIGHT}}
+
{{#set: common name=(3S)-2,3-epoxy-2,3-dihydrosqualene}}
{{#set: common name=UDP-glucose 6-dehydrogenase}}
+
{{#set: molecular weight=426.724    }}
{{#set: ec number=EC-1.1.1.22}}
+
{{#set: common name=squalene 2,3-epoxide|squalene 2,3-oxide|(S)-squalene-2,3-epoxide|2,3-EDSQ|2,3-epoxisqualene|oxidosqualene|2,3-oxidosqualene|(3S)-2,3-epoxysqualene}}
{{#set: gene associated=Ec-04_001130}}
+
{{#set: consumed by=CYCLOARTENOL-SYNTHASE-RXN}}
{{#set: in pathway=PWY-7346}}
+
{{#set: produced by=SQUALENE-MONOOXYGENASE-RXN}}
{{#set: reconstruction category=orthology|annotation}}
+
{{#set: reconstruction source=annotation-esiliculosus_genome|orthology-aragem}}
+
{{#set: reconstruction tool=pantograph|pathwaytools}}
+

Latest revision as of 19:17, 21 March 2018

Metabolite EPOXYSQUALENE

  • smiles:
    • CC(C)=CCCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CC[CH]1(C(C)(C)O1)
  • inchi key:
    • InChIKey=QYIMSPSDBYKPPY-RSKUXYSASA-N
  • common name:
    • (3S)-2,3-epoxy-2,3-dihydrosqualene
  • molecular weight:
    • 426.724
  • Synonym(s):
    • squalene 2,3-epoxide
    • squalene 2,3-oxide
    • (S)-squalene-2,3-epoxide
    • 2,3-EDSQ
    • 2,3-epoxisqualene
    • oxidosqualene
    • 2,3-oxidosqualene
    • (3S)-2,3-epoxysqualene

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

External links

  • CAS : 9029-62-3
  • PUBCHEM:
  • HMDB : HMDB01188
  • LIGAND-CPD:
  • CHEMSPIDER:
  • CHEBI:
  • METABOLIGHTS : MTBLC15441
"CC(C)=CCCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CC[CH]1(C(C)(C)O1)" cannot be used as a page name in this wiki.