Difference between revisions of "CPD-9903"

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(Created page with "Category:metabolite == Metabolite CPD-7139 == * common-name: ** delphinidin 3,5-di-o-β-d-glucoside * smiles: ** c(o)c1(c(o)c(o)c(o)c(o1)oc5(c4(c=c(oc2(c(o)c(o)c(o)c(c...")
(Created page with "Category:metabolite == Metabolite CPD-9903 == * common-name: ** 3,4-dihydroxy-5-all-trans-heptaprenylbenzoate * smiles: ** cc(c)=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=ccc1(=...")
 
(2 intermediate revisions by one other user not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-7139 ==
+
== Metabolite CPD-9903 ==
 
* common-name:
 
* common-name:
** delphinidin 3,5-di-o-β-d-glucoside
+
** 3,4-dihydroxy-5-all-trans-heptaprenylbenzoate
 
* smiles:
 
* smiles:
** c(o)c1(c(o)c(o)c(o)c(o1)oc5(c4(c=c(oc2(c(o)c(o)c(o)c(co)o2))c(c3(c=c(o)c(o)=c(o)c=3))=[o+]c=4c=c([o-])c=5)))
+
** cc(c)=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=ccc1(=c(c(=cc(c([o-])=o)=c1)o)o))c)c)c)c)c)c
 
* inchi-key:
 
* inchi-key:
** xctgxgvgjyacei-lcenjuansa-n
+
** lieylsgxgoxytd-ctbyciiysa-m
 
* molecular-weight:
 
* molecular-weight:
** 626.524
+
** 629.941
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
 +
* [[RXN-9287]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-8228]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=delphinidin 3,5-di-o-β-d-glucoside}}
+
{{#set: common-name=3,4-dihydroxy-5-all-trans-heptaprenylbenzoate}}
{{#set: inchi-key=inchikey=xctgxgvgjyacei-lcenjuansa-n}}
+
{{#set: inchi-key=inchikey=lieylsgxgoxytd-ctbyciiysa-m}}
{{#set: molecular-weight=626.524}}
+
{{#set: molecular-weight=629.941}}

Latest revision as of 11:15, 18 March 2021

Metabolite CPD-9903

  • common-name:
    • 3,4-dihydroxy-5-all-trans-heptaprenylbenzoate
  • smiles:
    • cc(c)=cccc(=cccc(=cccc(=cccc(=cccc(=cccc(=ccc1(=c(c(=cc(c([o-])=o)=c1)o)o))c)c)c)c)c)c
  • inchi-key:
    • lieylsgxgoxytd-ctbyciiysa-m
  • molecular-weight:
    • 629.941

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality