MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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5-methoxytryptamine

	Properties	Image
MNX_ID	MNXM6360
reference	chebi:166874
formula	C₁₁H₁₅N₂O
global charge	1
mol weight	191.254
InChIKey	JTEJPPKMYBDEMY-UHFFFAOYSA-O
InChI	InChI=1S/C11H14N2O/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11/h2-3,6-7,13H,4-5,12H2,1H3/p+1
SMILES	COC1=CC=C2NC=C(CC[NH3+])C2=C1

MNX internals

InChI (mnx)	InChI=1/C11H14N2O/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11/h2-3,6-7,13H,4-5,12H2,1H3
SMILES (mnx)	[CH3:1][O:14][C:9]1=[CH:6][C:10]2=[C:11]([CH:3]=[CH:2]1)[NH:13][CH:7]=[C:8]2[CH2:4][CH2:5][NH2:12]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	4

Similar chemical compounds in external resources
Identifier	Description
CHEBI:166874 chebi:166874 JTEJPPKMYBDEMY-UHFFFAOYSA-O	5-methoxytryptamine 2-(5-methoxy-1H-indol-3-yl)ethanaminium 5-methoxytryptamine cation 5-methoxytryptamine(1+) 5-methoxytryptaminium O-methylserotonin(1+)
seed.compound:cpd03370 seedM:cpd03370 JTEJPPKMYBDEMY-UHFFFAOYSA-O	5-MeOT 5-Methoxytryptamine 5-methoxytryptamine O-methylserotonin methoxytryptamine mexamine
sabiork.compound:8046 sabiorkM:8046 JTEJPPKMYBDEMY-UHFFFAOYSA-N	5-Methoxytryptamine
hmdb:HMDB0004095 JTEJPPKMYBDEMY-UHFFFAOYSA-N	5-Methoxytryptamine 2-(5-Methoxy-1H-indol-3-yl)ethanamine 2-(5-Methoxyindol-3-yl)ethylamine 2-(5-methoxy-1H-indol-3-yl)ethan-1-amine 3-(2-Aminoethyl)-5-methoxyindole 5 Methoxytryptamine 5 methoxytryptamine 5-MT 5-MeOT 5-Methoxy-1H-indole-3-ethanamine 5-Mot 5MOT Lopac-m-6628 Meksamin Meksamine Methoxytryptamine Mexamine Mexamine base
vmhM:5mtrptmn vmhmetabolite:5mtrptmn JTEJPPKMYBDEMY-UHFFFAOYSA-N	5-Methoxytryptamine 2-(5-methoxy-1H-indol-3-yl)ethan-1-amine
kegg.compound:C05659 keggC:C05659 JTEJPPKMYBDEMY-UHFFFAOYSA-N	5-Methoxytryptamine 5-MeOT
CHEBI:2089 chebi:2089 JTEJPPKMYBDEMY-UHFFFAOYSA-N	5-methoxytryptamine 2-(5-methoxy-1H-indol-3-yl)ethanamine 2-(5-methoxyindol-3-yl)ethylamine 3-(2-aminoethyl)-5-methoxyindole 5-MT 5-MeOT 5-Methoxytryptamine 5-Mot 5-methoxy-1H-indole-3-ethanamine 5MOT O-methylserotonin mexamine
metacyc.compound:CPD-12018 metacycM:CPD-12018 JTEJPPKMYBDEMY-UHFFFAOYSA-O	5-methoxytryptamine O-methylserotonin methoxytryptamine mexamine
envipath:...1dd61feda0f8 envipathM:...1dd61feda0f8 JTEJPPKMYBDEMY-UHFFFAOYSA-N	compound 0226147
hmdb:HMDB04095 keggC:M_C05659 seedM:M_cpd03370 vmhM:M_5mtrptmn	secondary/obsolete/fantasy identifier