Difference between revisions of "CPD-9965"

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(Created page with "Category:metabolite == Metabolite CPD-479 == * common-name: ** 4-(methylsulfanyl)-2-oxobutanoate * smiles: ** csccc(c([o-])=o)=o * inchi-key: ** sxfsqzdsuwackx-uhfffaoysa-...")
(Created page with "Category:metabolite == Metabolite CPD-7409 == * common-name: ** β-cryptoxanthin * smiles: ** cc(=cc=cc=c(c=cc=c(c=cc1(c(c)(c)cc(cc=1c)o))c)c)c=cc=c(c=cc2(=c(cccc(c)(c...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-479 ==
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== Metabolite CPD-7409 ==
 
* common-name:
 
* common-name:
** 4-(methylsulfanyl)-2-oxobutanoate
+
** β-cryptoxanthin
 
* smiles:
 
* smiles:
** csccc(c([o-])=o)=o
+
** cc(=cc=cc=c(c=cc=c(c=cc1(c(c)(c)cc(cc=1c)o))c)c)c=cc=c(c=cc2(=c(cccc(c)(c)2)c))c
 
* inchi-key:
 
* inchi-key:
** sxfsqzdsuwackx-uhfffaoysa-m
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** dmaslkhvqrhnes-fkkupvfpsa-n
 
* molecular-weight:
 
* molecular-weight:
** 147.168
+
** 552.882
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-14147]]
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* [[RXN-8026]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[R147-RXN]]
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* [[RXN-8025]]
* [[RXN-14147]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=4-(methylsulfanyl)-2-oxobutanoate}}
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{{#set: common-name=β-cryptoxanthin}}
{{#set: inchi-key=inchikey=sxfsqzdsuwackx-uhfffaoysa-m}}
+
{{#set: inchi-key=inchikey=dmaslkhvqrhnes-fkkupvfpsa-n}}
{{#set: molecular-weight=147.168}}
+
{{#set: molecular-weight=552.882}}

Revision as of 11:13, 15 January 2021

Metabolite CPD-7409

  • common-name:
    • β-cryptoxanthin
  • smiles:
    • cc(=cc=cc=c(c=cc=c(c=cc1(c(c)(c)cc(cc=1c)o))c)c)c=cc=c(c=cc2(=c(cccc(c)(c)2)c))c
  • inchi-key:
    • dmaslkhvqrhnes-fkkupvfpsa-n
  • molecular-weight:
    • 552.882

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality