Difference between revisions of "THIAMINE-P"

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(Created page with "Category:metabolite == Metabolite CPDMETA-13652 == * common-name: ** raucaffrinoline * smiles: ** cc3(n5(c2(c1(=nc6(=cc=cc=c(c41(c(c(c(c2)c(co)3)c(c4)5)oc(=o)c))6))))) * i...")
(Created page with "Category:metabolite == Metabolite STEARIC_ACID == * common-name: ** stearate * smiles: ** cccccccccccccccccc(=o)[o-] * inchi-key: ** qiqxthqidytfrh-uhfffaoysa-m * molecula...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPDMETA-13652 ==
+
== Metabolite STEARIC_ACID ==
 
* common-name:
 
* common-name:
** raucaffrinoline
+
** stearate
 
* smiles:
 
* smiles:
** cc3(n5(c2(c1(=nc6(=cc=cc=c(c41(c(c(c(c2)c(co)3)c(c4)5)oc(=o)c))6)))))
+
** cccccccccccccccccc(=o)[o-]
 
* inchi-key:
 
* inchi-key:
** ximpcxfldskalh-vqhwpedhsa-n
+
** qiqxthqidytfrh-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 352.432
+
** 283.473
 
== 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 ==
* [[RXN-12673]]
+
* [[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=raucaffrinoline}}
+
{{#set: common-name=stearate}}
{{#set: inchi-key=inchikey=ximpcxfldskalh-vqhwpedhsa-n}}
+
{{#set: inchi-key=inchikey=qiqxthqidytfrh-uhfffaoysa-m}}
{{#set: molecular-weight=352.432}}
+
{{#set: molecular-weight=283.473}}

Revision as of 18:55, 14 January 2021

Metabolite STEARIC_ACID

  • common-name:
    • stearate
  • smiles:
    • cccccccccccccccccc(=o)[o-]
  • inchi-key:
    • qiqxthqidytfrh-uhfffaoysa-m
  • molecular-weight:
    • 283.473

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality