Difference between revisions of "CPD-5846"

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(Created page with "Category:reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14047 RXN-14047] == * direction: ** reversible * ec-number: ** [http://enzyme.expasy.org/EC/4.2...")
(Created page with "Category:metabolite == Metabolite CPD-5846 == * common-name: ** 3β-hydroxy-4β-methyl-5α-cholest-7-ene-4α-carboxylate * smiles: ** cc(c)cccc(c)[ch]4(c...")
 
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[[Category:reaction]]
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[[Category:metabolite]]
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== Reaction [http://metacyc.org/META/NEW-IMAGE?object=RXN-14047 RXN-14047] ==
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== Metabolite CPD-5846 ==
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* direction:
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* common-name:
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** reversible
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** 3β-hydroxy-4β-methyl-5α-cholest-7-ene-4α-carboxylate
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* ec-number:
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* smiles:
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** [http://enzyme.expasy.org/EC/4.2.1.3 ec-4.2.1.3]
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** cc(c)cccc(c)[ch]4(cc[ch]3(c(c)(cc[ch]2(c(=cc[ch]1(c(c)(c([o-])=o)c(ccc(c)12)o))3))4))
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== Reaction formula ==
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* inchi-key:
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* 1 [[CIT]][c] '''<=>''' 1 [[THREO-DS-ISO-CITRATE]][c]
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** uqfzktihsicspg-dshyqqbwsa-m
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== Gene(s) associated with this reaction  ==
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* molecular-weight:
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* Gene: [[SJ22396]]
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** 443.688
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** Category: [[orthology]]
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== Reaction(s) known to consume the compound ==
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*** Source: [[output_pantograph_ectocarpus_siliculosus]], Tool: [[pantograph]], Assignment: n.a, Comment: n.a
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* [[1.1.1.170-RXN]]
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* Gene: [[SJ18471]]
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== Reaction(s) known to produce the compound ==
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** Category: [[annotation]]
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* [[1.1.1.170-RXN]]
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*** Source: [[saccharina_japonica_genome]], Tool: [[pathwaytools]], Assignment: ec-number, Comment: n.a
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== Reaction(s) of unknown directionality ==
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** Category: [[orthology]]
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{{#set: common-name=3&beta;-hydroxy-4&beta;-methyl-5&alpha;-cholest-7-ene-4&alpha;-carboxylate}}
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*** Source: [[output_pantograph_ectocarpus_siliculosus]], Tool: [[pantograph]], Assignment: n.a, Comment: n.a
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{{#set: inchi-key=inchikey=uqfzktihsicspg-dshyqqbwsa-m}}
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== Pathway(s) ==
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{{#set: molecular-weight=443.688}}
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== Reconstruction information  ==
 
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* category: [[orthology]]; source: [[output_pantograph_ectocarpus_siliculosus]]; tool: [[pantograph]]; comment: n.a
 
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* category: [[annotation]]; source: [[saccharina_japonica_genome]]; tool: [[pathwaytools]]; comment: n.a
 
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== External links  ==
 
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* RHEA:
 
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** [http://www.ebi.ac.uk/rhea/reaction.xhtml?id=10339 10339]
 
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* LIGAND-RXN:
 
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** [http://www.genome.jp/dbget-bin/www_bget?R01324 R01324]
 
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{{#set: direction=reversible}}
 
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{{#set: ec-number=ec-4.2.1.3}}
 
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{{#set: nb gene associated=2}}
 
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{{#set: nb pathway associated=0}}
 
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{{#set: reconstruction category=annotation|orthology}}
 
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{{#set: reconstruction tool=pantograph|pathwaytools}}
 
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{{#set: reconstruction comment=n.a}}
 
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{{#set: reconstruction source=output_pantograph_ectocarpus_siliculosus|saccharina_japonica_genome}}
 

Latest revision as of 11:15, 18 March 2021

Metabolite CPD-5846

  • common-name:
    • 3β-hydroxy-4β-methyl-5α-cholest-7-ene-4α-carboxylate
  • smiles:
    • cc(c)cccc(c)[ch]4(cc[ch]3(c(c)(cc[ch]2(c(=cc[ch]1(c(c)(c([o-])=o)c(ccc(c)12)o))3))4))
  • inchi-key:
    • uqfzktihsicspg-dshyqqbwsa-m
  • molecular-weight:
    • 443.688

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality

Retrieved from "https://gem-aureme.genouest.org/sjapgem/index.php?title=CPD-5846&oldid=138475"