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tropanyl 3,5-dimethylbenzoate
A tropane alkaloid that consists of tropine in which the hydrogen of the hydroxy function is substituted by a 3,5-dimethylbenzoyl group.


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03. Biological Effects of Specific Chemicals: pharmacological uses [CHEBI:52210] > neurotransmitter agent [CHEBI:35942] > serotonergic drug [CHEBI:48278] > serotonergic antagonist [CHEBI:48279] > tropanyl 3,5-dimethylbenzoate [CHEBI:64142]
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03. Biological Effects of Specific Chemicals 
03. Biological Effects of Specific Chemicals
 pharmacological uses [CHEBI:52210] (736) 
 neurotransmitter agent [CHEBI:35942] (471) 
 serotonergic drug [CHEBI:48278] (109) 
 serotonergic antagonist [CHEBI:48279] (52) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
08. Chemical Category 
08. Chemical Category
 main group molecular entity [CHEBI:33579] (25650) 
 p-block molecular entity [CHEBI:33675] (25343) 
 pnictogen molecular entity [CHEBI:33302] (10027) 
 nitrogen molecular entity [CHEBI:51143] (7930) 
 organonitrogen compound [CHEBI:35352] (6705) 
 alkaloid [CHEBI:22315] (473) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organonitrogen heterocyclic compound [CHEBI:38101] (3202) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 chalcogen molecular entity [CHEBI:33304] (15225) 
 oxygen molecular entity [CHEBI:25806] (14414) 
 organooxygen compound [CHEBI:36963] (11352) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 benzoate ester [CHEBI:36054] (83) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 benzoate ester [CHEBI:36054] (83) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 carbon group molecular entity [CHEBI:33582] (23847) 
 organic molecular entity [CHEBI:50860] (23769) 
 heteroorganic entity [CHEBI:33285] (15197) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 organonitrogen heterocyclic compound [CHEBI:38101] (3202) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organonitrogen compound [CHEBI:35352] (6705) 
 alkaloid [CHEBI:22315] (473) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organonitrogen heterocyclic compound [CHEBI:38101] (3202) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organochalcogen compound [CHEBI:36962] (11874) 
 organooxygen compound [CHEBI:36963] (11352) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 benzoate ester [CHEBI:36054] (83) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 ester [CHEBI:35701] (3370) 
 carboxylic ester [CHEBI:33308] (1495) 
 benzoate ester [CHEBI:36054] (83) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 aromatic ester [CHEBI:62732] (94) 
 benzoate ester [CHEBI:36054] (83) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic molecule [CHEBI:72695] (11399) 
 organic cyclic compound [CHEBI:33832] (7633) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 organonitrogen heterocyclic compound [CHEBI:38101] (3202) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic oxo compound [CHEBI:36587] (5932) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 benzoate ester [CHEBI:36054] (83) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 polyatomic entity [CHEBI:36357] (18777) 
 molecule [CHEBI:25367] (11520) 
 cyclic compound [CHEBI:33595] (7817) 
 polycyclic compound [CHEBI:33635] (4078) 
 heteropolycyclic compound [CHEBI:33671] (2613) 
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 bicyclic compound [CHEBI:33636] (1511) 
 heterobicyclic compound [CHEBI:33672] (1315) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 aromatic compound [CHEBI:33655] (3799) 
 aromatic ester [CHEBI:62732] (94) 
 benzoate ester [CHEBI:36054] (83) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic cyclic compound [CHEBI:33832] (7633) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 organonitrogen heterocyclic compound [CHEBI:38101] (3202) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 heterocyclic compound [CHEBI:5686] (5275) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 organonitrogen heterocyclic compound [CHEBI:38101] (3202) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 heteropolycyclic compound [CHEBI:33671] (2613) 
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 heterobicyclic compound [CHEBI:33672] (1315) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic molecule [CHEBI:72695] (11399) 
 organic cyclic compound [CHEBI:33832] (7633) 
 organic heterocyclic compound [CHEBI:24532] (5243) 
 organonitrogen heterocyclic compound [CHEBI:38101] (3202) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic heteropolycyclic compound [CHEBI:38166] (2613) 
 organic heterobicyclic compound [CHEBI:27171] (1315) 
 azabicycloalkane [CHEBI:38295] (38) 
 tropane alkaloid [CHEBI:37332] (17) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
 organic oxo compound [CHEBI:36587] (5932) 
 carbonyl compound [CHEBI:36586] (5928) 
 carboxylic ester [CHEBI:33308] (1495) 
 benzoate ester [CHEBI:36054] (83) 
 tropanyl 3,5-dimethylbenzoate [CHEBI:64142] (1)
ChEBI Compound Accession Identifier  [CHEBI:64142]
ChEBI Compound Description  A tropane alkaloid that consists of tropine in which the hydrogen of the hydroxy function is substituted by a 3,5-dimethylbenzoyl group.
ChEBI Compound Identification Number  64142
ChEBI InChI Value  InChI=1S/C17H23NO2/c1-11-6-12(2)8-13(7-11)17(19)20-16-9-14-4-5-15(10-16)18(14)3/h6-8,14-16H,4-5,9-10H2,1-3H3/t14-,15+,16+
ChEBI InChIKey Value  HDDNYFLPWFSBLN-ZSHCYNCHSA-N
ChEBI Compound Name  tropanyl 3,5-dimethylbenzoate
ChEBI SMILES Value  CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)c1cc(C)cc(C)c1
ChEBI Substance ID  135610586
ChEBI URL  ChEBI:64142
ChemSpider ID  19969918
Ontomatica Chemical Accession Key (OnChAKey)  HDDNYFLPWFSBLN_ZSHCYNCHSA_N_000_000000
PubChem Compound ID  68600