Difference between revisions of "DIHYDROKAEMPFEROL-CMPD"

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(Created page with "Category:metabolite == Metabolite CPD-11519 == * common-name: ** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxyoctanoyl)-coa * smiles: ** ccc=ccc1(c(ccc(=o)1)cccccc(...")
(Created page with "Category:metabolite == Metabolite LINOLENIC_ACID == * common-name: ** α-linolenate * smiles: ** ccc=ccc=ccc=ccccccccc(=o)[o-] * inchi-key: ** dtosiqbpprvqhs-pdbxooch...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-11519 ==
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== Metabolite LINOLENIC_ACID ==
 
* common-name:
 
* common-name:
** 3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxyoctanoyl)-coa
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** α-linolenate
 
* smiles:
 
* smiles:
** ccc=ccc1(c(ccc(=o)1)cccccc(o)cc(sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ2(c(op([o-])(=o)[o-])c(o)c(o2)n4(c3(=c(c(n)=nc=n3)n=c4))))[o-])[o-])=o)
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** ccc=ccc=ccc=ccccccccc(=o)[o-]
 
* inchi-key:
 
* inchi-key:
** pddhcvxpabqiso-xjjfhseksa-j
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** dtosiqbpprvqhs-pdbxoochsa-m
 
* molecular-weight:
 
* molecular-weight:
** 1055.92
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** 277.426
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-10698]]
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* [[LINOLENOYL-RXN]]
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* [[LNLNCACOAL]]
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* [[RXN-1321]]
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* [[RXN-8497]]
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* [[llcoas]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-10697]]
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* [[RXN-1501_METACYC18.5]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=3-oxo-2-(cis-2'-pentenyl)-cyclopentane-1-(3r-hydroxyoctanoyl)-coa}}
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{{#set: common-name=α-linolenate}}
{{#set: inchi-key=inchikey=pddhcvxpabqiso-xjjfhseksa-j}}
+
{{#set: inchi-key=inchikey=dtosiqbpprvqhs-pdbxoochsa-m}}
{{#set: molecular-weight=1055.92}}
+
{{#set: molecular-weight=277.426}}

Revision as of 13:08, 14 January 2021

Metabolite LINOLENIC_ACID

  • common-name:
    • α-linolenate
  • smiles:
    • ccc=ccc=ccc=ccccccccc(=o)[o-]
  • inchi-key:
    • dtosiqbpprvqhs-pdbxoochsa-m
  • molecular-weight:
    • 277.426

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality