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

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octan-1-ol

	Properties	Image
MNX_ID	MNXM2410
reference	chebi:16188
formula	C₈H₁₈O
global charge	0
mol weight	130.231
InChIKey	KBPLFHHGFOOTCA-UHFFFAOYSA-N
InChI	InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
SMILES	CCCCCCCCO

MNX internals

InChI (mnx)	InChI=1/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
SMILES (mnx)	[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][OH:9]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	21
in models (compartimentalized)	6

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16188 chebi:16188 KBPLFHHGFOOTCA-UHFFFAOYSA-N	octan-1-ol 1-Octanol 1-Oktanol 1-hydroxyoctane OCTAN-1-OL capryl alcohol caprylic alcohol n-heptyl carbinol n-octan-1-ol primary octyl alcohol
envipath:...8bf4c5a3cd2b envipathM:...8bf4c5a3cd2b sabiork.compound:2149 sabiorkM:2149 KBPLFHHGFOOTCA-UHFFFAOYSA-N	1-Octanol
seed.compound:cpd00562 seedM:cpd00562 KBPLFHHGFOOTCA-UHFFFAOYSA-N	1-Octanol 1-octanol N-octanol N-octyl-alcohol OCTANOL caprylic alcohol octan-1-ol octanol octyl-alcohol
kegg.compound:C00756 keggC:C00756 KBPLFHHGFOOTCA-UHFFFAOYSA-N	1-Octanol Octan-1-ol
envipath:...0b2d055b6a50 envipathM:...0b2d055b6a50 envipath:...78921bfb94e2 envipathM:...78921bfb94e2 SLM:000389992 slm:000389992 KBPLFHHGFOOTCA-UHFFFAOYSA-N	1-octanol
sabiork.compound:24991 sabiorkM:24991 KBPLFHHGFOOTCA-UHFFFAOYSA-N	Octanol
hmdb:HMDB0001183 KBPLFHHGFOOTCA-UHFFFAOYSA-N	Octanol 1 Octanol 1-Hydroxyoctane 1-Octanol 1-Oktanol 2-Capryl alcohol 2-Octanol 2-Octanol ~99% Alcohol C-8 Alcohol, N-octyl Alfol 8 Capryl alcohol Caprylic alcohol DL-2-Octanol Dytol m-83 Emery 3322 Emery 3324 Epal 8 Heptyl carbinol Hexyl methyl carbinol Lorol 20 Lorol C8 N Octanol N Octyl alcohol N-Heptyl carbinol N-Octan-1-ol N-Octanol N-Octyl alcohol N-Octyl-alcohol Octan-1-ol Octan-2-ol Octan-2-ol 98+ % Octilin Octyl alcohol Octyl alcohol normal-primary Octyl-alcohol Prim-N-octyl alcohol Primary octyl alcohol Sipol L8 octan-1-ol octanol
lipidmaps:LMFA05000130 lipidmapsM:LMFA05000130 KBPLFHHGFOOTCA-UHFFFAOYSA-N	n-octanol 1-octanol FOH 8:0 Octan-1-ol
metacyc.compound:OCTANOL metacycM:OCTANOL KBPLFHHGFOOTCA-UHFFFAOYSA-N	octan-1-ol 1-octanol N-octanol N-octyl-alcohol caprylic alcohol octanol octyl-alcohol
CHEBI:37868 chebi:37868	octanol Oktanol Oktylalkohol hydoxyoctane hydoxyoctanes n-octanol octanols octyl alcohol
hmdb:HMDB01183 chebi:11269 chebi:25642 chebi:25643 chebi:44579 chebi:660 keggC:M_C00756 seedM:M_cpd00562	secondary/obsolete/fantasy identifier