Difference between revisions of "CPD-15687"

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(Created page with "Category:metabolite == Metabolite STEARIC_ACID == * common-name: ** stearate * smiles: ** cccccccccccccccccc(=o)[o-] * inchi-key: ** qiqxthqidytfrh-uhfffaoysa-m * molecula...")
(Created page with "Category:metabolite == Metabolite CPD-15687 == * common-name: ** 5-cis, 7-trans-3-oxo-tetradecadienoyl-coa * smiles: ** ccccccc=cc=ccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c...")
 
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite STEARIC_ACID ==
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== Metabolite CPD-15687 ==
 
* common-name:
 
* common-name:
** stearate
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** 5-cis, 7-trans-3-oxo-tetradecadienoyl-coa
 
* smiles:
 
* smiles:
** cccccccccccccccccc(=o)[o-]
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** ccccccc=cc=ccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
 
* inchi-key:
 
* inchi-key:
** qiqxthqidytfrh-uhfffaoysa-m
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** njxbfcfhvuiemz-qtjplklfsa-j
 
* molecular-weight:
 
* molecular-weight:
** 283.473
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** 983.813
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-11820-STEARIC_ACID/HYDROGEN-PEROXIDE//R-2-HYDROXYSTEARATE/WATER.58.]]
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* [[RXN-14799]]
* [[RXN-16380]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[LPLPS1AGPE180h]]
 
* [[RXN-1602-CPD-17271/WATER//CPD66-43/STEARIC_ACID/PROTON.46.]]
 
* [[RXN-9548]]
 
* [[RXN-9624]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=stearate}}
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{{#set: common-name=5-cis, 7-trans-3-oxo-tetradecadienoyl-coa}}
{{#set: inchi-key=inchikey=qiqxthqidytfrh-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=njxbfcfhvuiemz-qtjplklfsa-j}}
{{#set: molecular-weight=283.473}}
+
{{#set: molecular-weight=983.813}}

Latest revision as of 11:14, 18 March 2021

Metabolite CPD-15687

  • common-name:
    • 5-cis, 7-trans-3-oxo-tetradecadienoyl-coa
  • smiles:
    • ccccccc=cc=ccc(=o)cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
  • inchi-key:
    • njxbfcfhvuiemz-qtjplklfsa-j
  • molecular-weight:
    • 983.813

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality