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

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5-Hydroxytryptophol

	Properties	Image
MNX_ID	MNXM8173
reference	chebi:89825
formula	C₁₀H₁₁NO₂
global charge	0
mol weight	177.203
InChIKey	KQROHCSYOGBQGJ-UHFFFAOYSA-N
InChI	InChI=1S/C10H11NO2/c12-4-3-7-6-11-10-2-1-8(13)5-9(7)10/h1-2,5-6,11-13H,3-4H2
SMILES	OCCC1=CNC2=CC=C(O)C=C12

MNX internals

InChI (mnx)	InChI=1/C10H11NO2/c12-4-3-7-6-11-10-2-1-8(13)5-9(7)10/h1-2,5-6,11-13H,3-4H2
SMILES (mnx)	[CH:1]1=[CH:2][C:10]2=[C:9]([CH:5]=[C:8]1[OH:13])[C:7]([CH2:3][CH2:4][OH:12])=[CH:6][NH:11]2

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	5

Similar chemical compounds in external resources
Identifier	Description
CHEBI:89825 chebi:89825 KQROHCSYOGBQGJ-UHFFFAOYSA-N	5-Hydroxytryptophol 3-(2-hydroxyethyl)-1H-indol-5-ol 5-HTOL 5-Hydroxy-1H-Indole-3-ethanol(9CI) 5-Hydroxy-1H-indole-3-ethanol 5-Hydroxy-3-indole 5-Hydroxy-3-indoleacetic acid 5-Hydroxy-indole-acetic acid 5-Hydroxyindoacetic acid 5-Hydroxyindol 5-Hydroxyindolacetate 5-Hydroxyindolacetic acid 5-Hydroxyindole-3-ethanol 5-Hydroxyindole-acetic acid Hydroxyindoleacetic acid Hydroxytryptophol
seed.compound:cpd23049 seedM:cpd23049 KQROHCSYOGBQGJ-UHFFFAOYSA-N	1H-indole-3-ethanol, 5-hydroxy- 5-hydroxy-1H-indole-3-ethanol 5-hydroxyindole-3-ethanol 5-hydroxytryptophol hydroxytryptophol indole-3-ethanol, 5-hydroxy-
hmdb:HMDB0001855 KQROHCSYOGBQGJ-UHFFFAOYSA-N	5-Hydroxytryptophol 3-(2-hydroxyethyl)-1H-indol-5-ol 5-HTOL 5-Hydroxy-1H-indole-3-ethanol 5-Hydroxy-1H-indole-3-ethanol(9ci) 5-Hydroxy-3-indole 5-Hydroxy-3-indoleacetic acid 5-Hydroxy-indole-acetic acid 5-Hydroxyindoacetic acid 5-Hydroxyindol 5-Hydroxyindolacetate 5-Hydroxyindolacetic acid 5-Hydroxyindole-3-ethanol 5-Hydroxyindole-acetic acid Hydroxyindoleacetic acid Hydroxytryptophol hydroxytryptophol
bigg.metabolite:CE1918 biggM:CE1918 KQROHCSYOGBQGJ-UHFFFAOYSA-N	5-hydroxytryptophol
metacyc.compound:CPD-11671 metacycM:CPD-11671 KQROHCSYOGBQGJ-UHFFFAOYSA-N	5-hydroxytryptophol 1H-indole-3-ethanol, 5-hydroxy- 5-hydroxy-1H-indole-3-ethanol 5-hydroxyindole-3-ethanol hydroxytryptophol indole-3-ethanol, 5-hydroxy-
vmhM:CE1918 vmhmetabolite:CE1918 KQROHCSYOGBQGJ-UHFFFAOYSA-N	5-hydroxytryptophol 3-(2-hydroxyethyl)-1H-indol-5-ol
hmdb:HMDB01855 biggM:M_CE1918 seedM:M_cpd23049 vmhM:M_CE1918	secondary/obsolete/fantasy identifier