Difference between revisions of "CPD-10576"

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(Created page with "Category:metabolite == Metabolite CPD1G-1346 == * common-name: ** trehalose-trans-methoxy-mono-mycolate * smiles: ** ccccccccccccccccccccccccccc(c(occ1(oc(c(c(c1o)o)o)oc2(...")
(Created page with "Category:metabolite == Metabolite CPD-10576 == * common-name: ** 4-chlorosalicylate * smiles: ** c(c1(c=cc(cl)=cc=1o))([o-])=o * inchi-key: ** lwxfczxrfbuoor-uhfffaoysa-m...")
 
(3 intermediate revisions by 2 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD1G-1346 ==
+
== Metabolite CPD-10576 ==
 
* common-name:
 
* common-name:
** trehalose-trans-methoxy-mono-mycolate
+
** 4-chlorosalicylate
 
* smiles:
 
* smiles:
** ccccccccccccccccccccccccccc(c(occ1(oc(c(c(c1o)o)o)oc2(c(c(c(c(o2)co)o)o)o)))=o)c(o)cccccccccccccccc3(cc3c(c)cccccccccccccccc(oc)c(c)cccccccccccccccccc)
+
** c(c1(c=cc(cl)=cc=1o))([o-])=o
 
* inchi-key:
 
* inchi-key:
** amromufvhnpoeq-bzzonohysa-n
+
** lwxfczxrfbuoor-uhfffaoysa-m
 
* molecular-weight:
 
* molecular-weight:
** 1592.571
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** 171.56
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-9912]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN1G-1437]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=trehalose-trans-methoxy-mono-mycolate}}
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{{#set: common-name=4-chlorosalicylate}}
{{#set: inchi-key=inchikey=amromufvhnpoeq-bzzonohysa-n}}
+
{{#set: inchi-key=inchikey=lwxfczxrfbuoor-uhfffaoysa-m}}
{{#set: molecular-weight=1592.571}}
+
{{#set: molecular-weight=171.56}}

Latest revision as of 11:12, 18 March 2021

Metabolite CPD-10576

  • common-name:
    • 4-chlorosalicylate
  • smiles:
    • c(c1(c=cc(cl)=cc=1o))([o-])=o
  • inchi-key:
    • lwxfczxrfbuoor-uhfffaoysa-m
  • molecular-weight:
    • 171.56

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality