Difference between revisions of "CPD-8083"

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(Created page with "Category:metabolite == Metabolite HOMO-CIS-ACONITATE == * common-name: ** cis-homoaconitate * smiles: ** c(=o)([o-])c=c(ccc([o-])=o)c(=o)[o-] * inchi-key: ** bjypzfuwwjsak...")
(Created page with "Category:metabolite == Metabolite CPD-8083 == * common-name: ** 1-18:2-2-18:3-digalactosyldiacylglycerol * smiles: ** cccccc=ccc=ccccccccc(occ(coc2(oc(coc1(oc(co)c(o)c(o)c...")
 
(2 intermediate revisions by 2 users not shown)
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite HOMO-CIS-ACONITATE ==
+
== Metabolite CPD-8083 ==
 
* common-name:
 
* common-name:
** cis-homoaconitate
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** 1-18:2-2-18:3-digalactosyldiacylglycerol
 
* smiles:
 
* smiles:
** c(=o)([o-])c=c(ccc([o-])=o)c(=o)[o-]
+
** cccccc=ccc=ccccccccc(occ(coc2(oc(coc1(oc(co)c(o)c(o)c(o)1))c(o)c(o)c(o)2))oc(=o)cccccccc=ccc=ccc=ccc)=o
 
* inchi-key:
 
* inchi-key:
** bjypzfuwwjsakc-arjawskdsa-k
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** gkshydzifvnlss-ipdwfasdsa-n
 
* molecular-weight:
 
* molecular-weight:
** 185.113
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** 939.231
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[HOMOACONITATE-HYDRATASE-RXN]]
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* [[RXN-8314]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[HOMOACONITATE-HYDRATASE-RXN]]
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* [[RXN-8313]]
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=cis-homoaconitate}}
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{{#set: common-name=1-18:2-2-18:3-digalactosyldiacylglycerol}}
{{#set: inchi-key=inchikey=bjypzfuwwjsakc-arjawskdsa-k}}
+
{{#set: inchi-key=inchikey=gkshydzifvnlss-ipdwfasdsa-n}}
{{#set: molecular-weight=185.113}}
+
{{#set: molecular-weight=939.231}}

Latest revision as of 11:16, 18 March 2021

Metabolite CPD-8083

  • common-name:
    • 1-18:2-2-18:3-digalactosyldiacylglycerol
  • smiles:
    • cccccc=ccc=ccccccccc(occ(coc2(oc(coc1(oc(co)c(o)c(o)c(o)1))c(o)c(o)c(o)2))oc(=o)cccccccc=ccc=ccc=ccc)=o
  • inchi-key:
    • gkshydzifvnlss-ipdwfasdsa-n
  • molecular-weight:
    • 939.231

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality