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6-hydroxymelatonin

MNXM5567 is deprecated and here replaced by MNXM730977
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM730977 Image of MNXM730977
referencechebi:2198
formulaC13H16N2O3
global charge0
mol weight248.282
InChIKeyOMYMRCXOJJZYKE-UHFFFAOYSA-N
InChIInChI=1S/C13H16N2O3/c1-8(16)14-4-3-9-7-15-11-6-12(17)13(18-2)5-10(9)11/h5-7,15,17H,3-4H2,1-2H3,(H,14,16)
SMILESCOC1=CC2=C(C=C1O)NC=C2CCNC(C)=O
MNX internals
InChI (mnx)InChI=1/C13H16N2O3/c1-8(16)14-4-3-9-7-15-11-6-12(17)13(18-2)5-10(9)11/h5-7,15,17H,3-4H2,1-2H3,(H,14,16) Image of MNXM730977
SMILES (mnx)[CH3:1][C:8](=[N:14][CH2:4][CH2:3][C:9]1=[CH:7][NH:15][C:11]2=[CH:6][C:12]([OH:17])=[C:13]([O:18][CH3:2])[CH:5]=[C:10]12)[OH:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)11
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:2198
chebi:2198
OMYMRCXOJJZYKE-UHFFFAOYSA-N 		6-hydroxymelatonin
Lopac-H-0627
N-[2-(6-hydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide

sabiork.compound:8030
sabiorkM:8030
kegg.compound:C05643
keggC:C05643
OMYMRCXOJJZYKE-UHFFFAOYSA-N 		6-Hydroxymelatonin
hmdb:HMDB0004081
OMYMRCXOJJZYKE-UHFFFAOYSA-N 		6-Hydroxymelatonin
6-Hydroxy-N-acetyl-5-methoxytryptamine
6-Oxymelatonin
Lopac-H-0627
N-[2-(6-hydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide

seed.compound:cpd03354
seedM:cpd03354
OMYMRCXOJJZYKE-UHFFFAOYSA-N 		6-Hydroxymelatonin
6-hydroxymelatonin

vmhM:6hoxmelatn
vmhmetabolite:6hoxmelatn
OMYMRCXOJJZYKE-UHFFFAOYSA-N 		6-Hydroxymelatonin
N-[2-(6-hydroxy-5-methoxy-1H-indol-3-yl)ethyl]acetamide

metacyc.compound:CPD-12014
metacycM:CPD-12014
OMYMRCXOJJZYKE-UHFFFAOYSA-N 		6-hydroxymelatonin

bigg.metabolite:6hoxmelatn
biggM:6hoxmelatn
OMYMRCXOJJZYKE-UHFFFAOYSA-N 		6hoxmelatn c

hmdb:HMDB04081
biggM:M_6hoxmelatn
keggC:M_C05643
seedM:M_cpd03354
vmhM:M_6hoxmelatn 		secondary/obsolete/fantasy identifier