Difference between revisions of "CPD-712"

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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-712 == * common-name: ** 6-deoxocathasterone * smiles: ** cc(c)c(c)cc(o)c(c)[ch]3(cc[ch]4([ch]2(cc[ch]1(cc(o)ccc(c)1[ch]2ccc(c)34))))...")
 
(6 intermediate revisions by 3 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite STEARIC_ACID ==
+
== Metabolite CPD-712 ==
 
* common-name:
 
* common-name:
** stearate
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** 6-deoxocathasterone
 
* smiles:
 
* smiles:
** cccccccccccccccccc(=o)[o-]
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** cc(c)c(c)cc(o)c(c)[ch]3(cc[ch]4([ch]2(cc[ch]1(cc(o)ccc(c)1[ch]2ccc(c)34))))
 
* inchi-key:
 
* inchi-key:
** qiqxthqidytfrh-uhfffaoysa-m
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** zhzkwzjlunxosn-yuzbouazsa-n
 
* molecular-weight:
 
* molecular-weight:
** 283.473
+
** 418.702
 
== 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.]]
 
* [[RXN-16380]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[LPLPS1AGPE180h]]
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* [[RXN-773]]
* [[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=6-deoxocathasterone}}
{{#set: inchi-key=inchikey=qiqxthqidytfrh-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=zhzkwzjlunxosn-yuzbouazsa-n}}
{{#set: molecular-weight=283.473}}
+
{{#set: molecular-weight=418.702}}

Latest revision as of 11:14, 18 March 2021

Metabolite CPD-712

  • common-name:
    • 6-deoxocathasterone
  • smiles:
    • cc(c)c(c)cc(o)c(c)[ch]3(cc[ch]4([ch]2(cc[ch]1(cc(o)ccc(c)1[ch]2ccc(c)34))))
  • inchi-key:
    • zhzkwzjlunxosn-yuzbouazsa-n
  • molecular-weight:
    • 418.702

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality