MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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1,1-Dibromo-1-chloro-2-propanone
Properties
Image
Occurences in reactions
MNX_ID
MNXM115645
#reac
in my sandbox
0
in MNXref (generic)
0
in models (compartimentalized)
0
formula
C
3
H
3
Br
2
ClO
charge
0
mass
247.82392
reference
hmdb:HMDB0040187
InChIKey
DKJGWIKRAGVVKN-UHFFFAOYSA-N
InChI
InChI=1S/C3H3Br2ClO/c1-2(7)3(4,5)6/h1H3
SMILES
CC(=O)C(Cl)(Br)Br
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
hmdb:HMDB0040187
1,1-Dibromo-1-chloro-2-propanone
1,1-Dibromo-1-chloroacetone
1,1-dibromo-1-chloropropan-2-one
hmdb:HMDB40187
secondary/obsolete/fantasy identifier