Difference between revisions of "CPD-9897"

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(Created page with "Category:metabolite == Metabolite CPD-19150 == * common-name: ** (2e,5z)-dodecenoyl-coa * smiles: ** ccccccc=ccc=cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op...")
(Created page with "Category:metabolite == Metabolite CPD-10546 == * common-name: ** methyl (indol-3-yl)acetate * smiles: ** coc(=o)cc2(c1(c(=cc=cc=1)nc=2)) * inchi-key: ** kthadmdgdnyqrx-uhf...")
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[[Category:metabolite]]
 
[[Category:metabolite]]
== Metabolite CPD-19150 ==
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== Metabolite CPD-10546 ==
 
* common-name:
 
* common-name:
** (2e,5z)-dodecenoyl-coa
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** methyl (indol-3-yl)acetate
 
* smiles:
 
* smiles:
** ccccccc=ccc=cc(=o)sccnc(=o)ccnc(=o)c(o)c(c)(c)cop(=o)(op(=o)(occ1(c(op([o-])(=o)[o-])c(o)c(o1)n3(c2(=c(c(n)=nc=n2)n=c3))))[o-])[o-]
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** coc(=o)cc2(c1(c(=cc=cc=1)nc=2))
 
* inchi-key:
 
* inchi-key:
** zsjrxhrcabosnc-shjpognxsa-j
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** kthadmdgdnyqrx-uhfffaoysa-n
 
* molecular-weight:
 
* molecular-weight:
** 941.776
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** 189.213
 
== Reaction(s) known to consume the compound ==
 
== Reaction(s) known to consume the compound ==
* [[RXN-17797]]
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* [[RXN-10711]]
 
== Reaction(s) known to produce the compound ==
 
== Reaction(s) known to produce the compound ==
* [[RXN-17796]]
 
 
== Reaction(s) of unknown directionality ==
 
== Reaction(s) of unknown directionality ==
{{#set: common-name=(2e,5z)-dodecenoyl-coa}}
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{{#set: common-name=methyl (indol-3-yl)acetate}}
{{#set: inchi-key=inchikey=zsjrxhrcabosnc-shjpognxsa-j}}
+
{{#set: inchi-key=inchikey=kthadmdgdnyqrx-uhfffaoysa-n}}
{{#set: molecular-weight=941.776}}
+
{{#set: molecular-weight=189.213}}

Revision as of 14:57, 5 January 2021

Metabolite CPD-10546

  • common-name:
    • methyl (indol-3-yl)acetate
  • smiles:
    • coc(=o)cc2(c1(c(=cc=cc=1)nc=2))
  • inchi-key:
    • kthadmdgdnyqrx-uhfffaoysa-n
  • molecular-weight:
    • 189.213

Reaction(s) known to consume the compound

Reaction(s) known to produce the compound

Reaction(s) of unknown directionality