CHEBI:1391 - 3,4-methylenedioxymethamphetamine

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ChEBI Name 3,4-methylenedioxymethamphetamine ChEBI ID CHEBI:1391 Definition A member of the class of benzodioxoles that is 1,3-benzodioxole substituted by a 2-(methylamino)propyl group at position 5. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C11H15NO2 Net Charge 0 Average Mass 193.24234 Monoisotopic Mass 193.11028 InChI InChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3 InChIKey SHXWCVYOXRDMCX-UHFFFAOYSA-N SMILES CNC(C)Cc1ccc2OCOc2c1 Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Biological Role(s): neurotoxin A poison that interferes with the functions of the nervous system. Application(s): central nervous system stimulant Any drug that enhances the activity of the central nervous system. (via amphetamines ) View more via ChEBI Ontology ChEBI Ontology Outgoing 3,4-methylenedioxymethamphetamine (CHEBI:1391) has role neurotoxin (CHEBI:50910) 3,4-methylenedioxymethamphetamine (CHEBI:1391) is a amphetamines (CHEBI:35338) 3,4-methylenedioxymethamphetamine (CHEBI:1391) is a benzodioxoles (CHEBI:38298) IUPAC Name 1-(1,3-benzodioxol-5-yl)-N-methylpropan-2-amine Synonyms Sources (RS)-3,4-(methylenedioxy)methamphetamine ChemIDplus 1-(1,3-Benzodioxol-5-yl)-N-methyl-2-propanamine NIST Chemistry WebBook 3,4-Methylenedioxymethamphetamine KEGG COMPOUND DL-(3,4-Methylenedioxy)methamphetamine ChemIDplus ecstasy Note: (2016-06-20) The name "ecstasy" is no longer used only for MDMA, but for the whole group of ring-substituted amphetamines (RSAs) including MDA, MDMA, MDEA and MBDB, as they are chemically and pharmacologically nearly identical; moreover, many ecstasy pills contain mixtures of the RSAs. ChEBI MDMA KEGG COMPOUND MDMA ChemIDplus N,α-dimethyl-1,3-benzodioxole-5-ethanamine NIST Chemistry WebBook N-Methyl-3,4-methylenedioxyamphetamine KEGG COMPOUND Manual Xrefs Databases C07577 KEGG COMPOUND DB01454 DrugBank HMDB0041931 HMDB MDMA Wikipedia View more database links Registry Numbers Types Sources 158675 Reaxys Registry Number Reaxys 42542-10-9 CAS Registry Number KEGG COMPOUND 42542-10-9 CAS Registry Number ChemIDplus Citations Types Sources 15062945 PubMed citation Europe PMC 18570171 PubMed citation Europe PMC Last Modified 20 June 2016

General Comment 2005-08-19 The active ingredient in the recreational drug ecstasy.