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

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1-propanol

	Properties	Image
MNX_ID	MNXM6396
reference	chebi:28831
formula	C₃H₈O
global charge	0
mol weight	60.096
InChIKey	BDERNNFJNOPAEC-UHFFFAOYSA-N
InChI	InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
SMILES	CCCO

MNX internals

InChI (mnx)	InChI=1/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
SMILES (mnx)	[CH3:1][CH2:2][CH2:3][OH:4]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	23
in models (compartimentalized)	7

Similar chemical compounds in external resources
Identifier	Description
CHEBI:28831 chebi:28831 BDERNNFJNOPAEC-UHFFFAOYSA-N	1-propanol 1-Hydroxypropane 1-Propanol Ethylcarbinol N-PROPANOL Optal Osmosol extra Propan-1-ol Propane-1-ol Propanol Propyl alcohol UN 1274 ethyl carbinol n-Propanol n-Propyl alcohol n-Propylalkohol n-propan-1-ol propan-1-ol propanol-1
bigg.metabolite:ppoh biggM:ppoh vmhM:ppoh vmhmetabolite:ppoh BDERNNFJNOPAEC-UHFFFAOYSA-N	1-Propanol
sabiork.compound:2834 sabiorkM:2834 BDERNNFJNOPAEC-UHFFFAOYSA-N	1-Propanol 1-Hydroxypropane Ethylcarbinol Optal Osmosol extra Propan-1-ol Propane-1-ol Propanol Propyl alcohol UN 1274 n-Propanol n-Propyl alcohol
seed.compound:cpd03559 seedM:cpd03559 BDERNNFJNOPAEC-UHFFFAOYSA-N	Optal 1-Hydroxypropane 1-Propanol 1-hydroxypropane 1-propanol Ethylcarbinol Osmosol extra Propan-1-ol Propane-1-ol Propanol Propyl alcohol UN 1274 ethylcarbinol n-Propanol n-Propyl alcohol n-propanol optal osmosol extra propan-1-ol propane-1-ol propanol propylalcohol
lipidmaps:LMFA05000101 lipidmapsM:LMFA05000101 BDERNNFJNOPAEC-UHFFFAOYSA-N	Propan-1-ol FOH 3:0 Propan-1-ol
kegg.compound:C05979 keggC:C05979 BDERNNFJNOPAEC-UHFFFAOYSA-N	Propane-1-ol 1-Hydroxypropane 1-Propanol Ethylcarbinol Optal Osmosol extra Propan-1-ol Propanol Propyl alcohol UN 1274 n-Propanol n-Propyl alcohol
hmdb:HMDB0000820 BDERNNFJNOPAEC-UHFFFAOYSA-N	Propyl alcohol 1 Propanol 1-Hydroxypropane 1-Propanol 1-Propyl alcohol Alcohol, propyl Ethyl carbinol Ethylcarbinol Hydroxypropane N Propanol N-Propan-1-ol N-Propanol N-Propyl alcohol N-Propylalkohol Optal Osmosol extra Propan-1-ol Propane-1-ol Propanol Propanol-1 Propanole Propanolen Propylan-propyl alcohol Propylic alcohol UN 1274 propan-1-ol propanol
envipath:...898c30996527 envipathM:...898c30996527 BDERNNFJNOPAEC-UHFFFAOYSA-N	compound 0039714
envipath:...05ec852715a9 envipathM:...05ec852715a9 BDERNNFJNOPAEC-UHFFFAOYSA-N	compound 0050190
metacyc.compound:PROPANOL metacycM:PROPANOL BDERNNFJNOPAEC-UHFFFAOYSA-N	propan-1-ol 1-hydroxypropane 1-propanol ethylcarbinol n-propanol optal osmosol extra propanol propylalcohol
hmdb:HMDB00820 chebi:26278 chebi:44960 chebi:8472 biggM:M_ppoh keggC:M_C05979 seedM:M_cpd03559 vmhM:M_ppoh	secondary/obsolete/fantasy identifier