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- Q4596728 subject Q7158322.
- Q4596728 subject Q7484882.
- Q4596728 subject Q8388304.
- Q4596728 subject Q8600287.
- Q4596728 subject Q8873601.
- Q4596728 abstract "2′-Acetoxycocaine (ortho-acetoxy-cocaine) is a cocaine analog, with a quicker effect onset than cocaine. The acetoxy branch renders the molecule a QSAR of a 4-fold increase over cocaine in its binding potency for the dopamine transporter & a 35-fold enhanced affinity for the norepinephrine transporter. It also has a reduced selectivity for the serotonin transporter (though only due to its greater increase at NET & DAT binding being of such an order of magnitude more by comparison). In overall binding affinity (not uptake inhibition) it displaces ligands better across the board than cocaine in all monoamine categories. Salicylmethylecgonine would be an intermediate metabolite in vivo in humans (therefore affecting the overall effect profile of the administered 2′-acetoxy analog via its metabolic route; giving it nearly three times the affinity for DAT, after onset, and greaten the affinity that is would have for NET by a halve more than on upon initial exposure, after rapid deacetylation.) 2′-Acetoxycocaine has a closer to optimum LogP (a square value of 2) for blood–brain barrier penetration (cocaine being higher and logarithmically four times the optimal lipophilicity allowing too much of the compound to be dumped out directly into fatty tissue instead of reaching its target site) this would make it a prodrug to salicylmethylecgonine due to the latter having a less (and the ortho-acetoxy analog having a more) efficacious LogP than its cocaine parent.ɑPredictive algorithm used is dynamic and subject to change as database expands, should be taken as suggestive values, and only putative/uncertain as exact quantitative value is concerned.↑ ↑".
- Q4596728 iupacName "(1R,2R,3S,5S)-Methyl 3-((2-acetoxybenzoyl)oxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate".
- Q4596728 thumbnail 2-Acetoxycocaine.svg?width=300.
- Q4596728 wikiPageWikiLink Q221694.
- Q4596728 wikiPageWikiLink Q603741.
- Q4596728 wikiPageWikiLink Q6610369.
- Q4596728 wikiPageWikiLink Q7158322.
- Q4596728 wikiPageWikiLink Q7404462.
- Q4596728 wikiPageWikiLink Q7484882.
- Q4596728 wikiPageWikiLink Q766383.
- Q4596728 wikiPageWikiLink Q796604.
- Q4596728 wikiPageWikiLink Q8388304.
- Q4596728 wikiPageWikiLink Q8600287.
- Q4596728 wikiPageWikiLink Q8873601.
- Q4596728 wikiPageWikiLink Q898401.
- Q4596728 wikiPageWikiLink Q898797.
- Q4596728 iupacname "-Methyl 3--8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate".
- Q4596728 type ChemicalCompound.
- Q4596728 type ChemicalSubstance.
- Q4596728 type ChemicalObject.
- Q4596728 type Thing.
- Q4596728 type Q11173.
- Q4596728 comment "2′-Acetoxycocaine (ortho-acetoxy-cocaine) is a cocaine analog, with a quicker effect onset than cocaine. The acetoxy branch renders the molecule a QSAR of a 4-fold increase over cocaine in its binding potency for the dopamine transporter & a 35-fold enhanced affinity for the norepinephrine transporter. It also has a reduced selectivity for the serotonin transporter (though only due to its greater increase at NET & DAT binding being of such an order of magnitude more by comparison).".
- Q4596728 label "2′-Acetoxycocaine".
- Q4596728 depiction 2-Acetoxycocaine.svg.