Difference between revisions of "GAMMA-BUTYROBETAINE"

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(Created page with "Category:metabolite == Metabolite S2O3 == * common-name: ** thiosulfate * smiles: ** o=s(=o)([o-])s * inchi-key: ** dhcdfwkwkrszhf-uhfffaoysa-m * molecular-weight: ** 113....")
(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))))...")
Line 1: Line 1:
 
[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite S2O3 ==
+
== Metabolite CPD-712 ==
 
* common-name:
 
* common-name:
** thiosulfate
+
** 6-deoxocathasterone
 
* smiles:
 
* smiles:
** o=s(=o)([o-])s
+
** 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:
** dhcdfwkwkrszhf-uhfffaoysa-m
+
** zhzkwzjlunxosn-yuzbouazsa-n
 
* molecular-weight:
 
* molecular-weight:
** 113.126
+
** 418.702
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[SULFOCYS-RXN]]
 
* [[THIOSULFATE-SULFURTRANSFERASE-RXN]]
 
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[SULFOCYS-RXN]]
+
* [[RXN-773]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=thiosulfate}}
+
{{#set: common-name=6-deoxocathasterone}}
{{#set: inchi-key=inchikey=dhcdfwkwkrszhf-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=zhzkwzjlunxosn-yuzbouazsa-n}}
{{#set: molecular-weight=113.126}}
+
{{#set: molecular-weight=418.702}}

Revision as of 15:27, 5 January 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