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

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chloroacetaldehyde

	Properties	Image
MNX_ID	MNXM1816
reference	chebi:27871
formula	C₂H₃ClO
global charge	0
mol weight	78.498
InChIKey	QSKPIOLLBIHNAC-UHFFFAOYSA-N
InChI	InChI=1S/C2H3ClO/c3-1-2-4/h2H,1H2
SMILES	O=CCCl

MNX internals

InChI (mnx)	InChI=1/C2H3ClO/c3-1-2-4/h2H,1H2
SMILES (mnx)	[CH2:1]([CH:2]=[O:4])[Cl:3]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	13
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27871 chebi:27871 QSKPIOLLBIHNAC-UHFFFAOYSA-N	chloroacetaldehyde 2-Chloro-1-ethanal 2-Chloroethanal Chloroacetaldehyde Chloroaldehyde Monochloroacetaldehyde
seed.compound:cpd04134 seedM:cpd04134 QSKPIOLLBIHNAC-UHFFFAOYSA-N	2-Chloroethanal 2-chloroacetaldehyde 2-chloroethanal Chloroacetaldehyde chloroacetaldehyde chloroaldehyde chloroethanal monochloroacetaldehyde
envipath:...dd5afc3827bc envipathM:...dd5afc3827bc QSKPIOLLBIHNAC-UHFFFAOYSA-N	Chloroacetaldehyde
hmdb:HMDB0013860 QSKPIOLLBIHNAC-UHFFFAOYSA-N	Chloroacetaldehyde 2-Chloro-1-ethanal 2-Chloro-acetaldehyde 2-Chloroacetaldehyde 2-Chloroethanal 2-chloroacetaldehyde CH2ClCHO Chloroacetalaldehyde Chloroacetaldehyde hydrate Chloroacetaldehyde monomer Chloroaldehyde Chloroethanal Monochloroacetaldehyde Rcra waste number P023 chloroacetaldehyde
sabiork.compound:2916 sabiorkM:2916 kegg.compound:C06754 keggC:C06754 QSKPIOLLBIHNAC-UHFFFAOYSA-N	Chloroacetaldehyde 2-Chloroethanal
metacyc.compound:CHLOROACETALDEHYDE metacycM:CHLOROACETALDEHYDE QSKPIOLLBIHNAC-UHFFFAOYSA-N	chloroacetaldehyde 2-chloroacetaldehyde 2-chloroethanal chloroaldehyde chloroethanal monochloroacetaldehyde
envipath:...3df28d6eea46 envipathM:...3df28d6eea46 QSKPIOLLBIHNAC-UHFFFAOYSA-N	compound 0039894
hmdb:HMDB13860 chebi:23122 chebi:3621 keggC:M_C06754 seedM:M_cpd04134	secondary/obsolete/fantasy identifier