CHEBI:28136 - N-methyltryptamine

ChEBI IDCHEBI:28136
ChEBI NameN-methyltryptamine
Stars
ASCII NameN-methyltryptamine
Secondary ChEBI IDsCHEBI:7326, CHEBI:21774
Last Modified23 October 2015
DownloadsMolfile
FormulaC11H14N2
Net Charge0
Average Mass174.247
Monoisotopic Mass174.11570
SMILESCNCCc1cnc2ccccc12
InChIInChI=1S/C11H14N2/c1-12-7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,12-13H,6-7H2,1H3
InChIKeyNCIKQJBVUNUXLW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Paramuricea clavata (ncbitaxon:317549) - PubMed (21939218) CH2Cl2:MeOH(1:1) extract of lyophilized material
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
N-methyltryptamine (CHEBI:28136) has functional parent tryptamine (CHEBI:16765)
N-methyltryptamine (CHEBI:28136) has role metabolite (CHEBI:25212)
N-methyltryptamine (CHEBI:28136) is a tryptamine alkaloid (CHEBI:48274)
N-methyltryptamine (CHEBI:28136) is a tryptamines (CHEBI:27162)
N-methyltryptamine (CHEBI:28136) is conjugate base of N-methyltryptaminium (CHEBI:193123)
Incoming Relation(s)
N-methyltryptaminium (CHEBI:193123) is conjugate acid of N-methyltryptamine (CHEBI:28136)
IUPAC Name 
2-(1H-indol-3-yl)-N-methylethanamine
Synonyms  Source
N-MethyltryptamineKEGG COMPOUND
Nω-methyltryptamineNIST Chemistry WebBook
N-monomethyltryptamineChemIDplus
3-(2-methylaminoethyl)indoleChemIDplus
N-methyl-1H-indole-3-ethanamineChemIDplus
Manual XrefsDatabases
C06213KEGG COMPOUND
C00026521KNApSAcK
Registry NumbersSources
Beilstein:134134Beilstein
CAS:61-49-4ChemIDplus
CAS:61-49-4NIST Chemistry WebBook