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

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dimethyl sulfone

	Properties	Image
MNX_ID	MNXM3978
reference	chebi:9349
formula	C₂H₆O₂S
global charge	0
mol weight	94.135
InChIKey	HHVIBTZHLRERCL-UHFFFAOYSA-N
InChI	InChI=1S/C2H6O2S/c1-5(2,3)4/h1-2H3
SMILES	CS(C)(=O)=O

MNX internals

InChI (mnx)	InChI=1/C2H6O2S/c1-5(2,3)4/h1-2H3
SMILES (mnx)	[CH3:1][S:5]([CH3:2])(=[O:3])=[O:4]

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:9349 chebi:9349 HHVIBTZHLRERCL-UHFFFAOYSA-N	dimethyl sulfone Dimethyl sulfone Sulfonylbismethane dimethyl sulphone methylsulfonylmethane sulfonyldimethane sulphonylbismethane
hmdb:HMDB0004983 HHVIBTZHLRERCL-UHFFFAOYSA-N	Dimethyl sulfone (Methylsulfonyl)methane Dimethyl sulfone, 13C-labeled Dimethyl sulphone Dimethylsulfone Lignisul MSM Methyl sulfone Methyl sulfonmethane Methylsulfonylmethane Methylsulphonylmethane Opti MSM Sulfonylbis-methane Sulfonylbismethane Sulphonylbismethane Sulphonyldimethane methanesulfonylmethane methylsulfonylmethane
kegg.compound:C11142 keggC:C11142 HHVIBTZHLRERCL-UHFFFAOYSA-N	Dimethyl sulfone Sulfonylbismethane
seed.compound:cpd08020 seedM:cpd08020 HHVIBTZHLRERCL-UHFFFAOYSA-N	Dimethyl sulfone Sulfonylbismethane dimethyl sulfone dimethylsulfone methylsulfonylmethane sulfonyldimethane
metacyc.compound:CPD-10437 metacycM:CPD-10437 HHVIBTZHLRERCL-UHFFFAOYSA-N	dimethyl sulfone dimethylsulfone methylsulfonylmethane sulfonyldimethane
hmdb:HMDB0006702 hmdb:HMDB04983 hmdb:HMDB06702 keggC:M_C11142 seedM:M_cpd08020	secondary/obsolete/fantasy identifier