Molecule

S-methyl-L-methionine

AlkaPlorer ID: AK018411

Synonym: 'L-Methionine methylsulfonium', 'L-Methionine methylsulfonium iodide', 'S-Methyl-L-methionine'

IUPAC Name: (2S)-2-amino-4-dimethylsulfoniobutanoate

SMILES: C[S+](C)CC[C@H](N)C(=O)[O-]

InChI: InChI=1S/C6H13NO2S/c1-10(2)4-3-5(7)6(8)9/h5H,3-4,7H2,1-2H3/t5-/m0/s1

InChIKey: YDBYJHTYSHBBAU-YFKPBYRVSA-N

PubChem CID: 10197842

CAS: 4727-40-6

LOTUS: LTS0198786

SuperNatural Ⅲ: SN0396692-02

NPASS: NPC198215

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Hordeum vulgare	Hordeum	Poaceae	Poales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Camellia sinensis	Camellia	Theaceae	Ericales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Saccharomyces cerevisiae	Saccharomyces	Saccharomycetaceae	Saccharomycetales	Saccharomycetes	Ascomycota	Fungi	Eukaryota
Brassica oleracea	Brassica	Brassicaceae	Brassicales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Escherichia coli	Escherichia	Enterobacteriaceae	Enterobacterales	Gammaproteobacteria	Pseudomonadota	None	Bacteria
Hippophae rhamnoides	Hippophae	Elaeagnaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 163.242

TPSA？: 66.15

MolLogP？: -1.6683999999999974

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 0

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Homo sapiens	Solute carrier family 22 member 5	Activity	8.7	%	None

AKRT ID	Reaction	Reaction Link ID
AKRT000041	*C(=O)C(=O)O.C[S+](C)CC[C@H](N)C(=O)O>>C[S+](C)CCC=O	RXN-9759
AKRT001048	*[C@H](N)C(=O)O.C[S+](C)CCC=O>>C[S+](C)CC[C@H](N)C(=O)O	MNXR177576
AKRT002052	CC(=O)C(=O)O.C[S+](C)CC[C@H](N)C(=O)O>>CC(N[C@@H](CC[S+](C)C)C(=O)O)C(=O)O	RXN-14860
AKRT007077	CCC(=O)C(=O)O.CSC>>C[S+](C)CC[C@H](N)C(=O)O	MNXR133356
AKRT012350	CSCC[C@H](N)C(=O)O.C[SAH]>>C[S+](C)CC[C@H](N)C(=O)O	METHIONINE-S-METHYLTRANSFERASE-RXN
AKRT014460	C[S+](C)CC[C@H](N)C(=O)O.N[C@@H](CCS)C(=O)O>>CSCC[C@H](N)C(=O)O	MMUM-RXN
AKRT014461	C[S+](C)CC[C@H](N)C(=O)O.N[C@@H](CCS)C(=O)O>>CSCC[C@H](N)C(=O)O.CSCC[C@H](N)C(=O)O	None
AKRT014462	C[S+](C)CC[C@H](N)C(=O)O.N[C@@H](C[SeH])C(=O)O>>CSCC[C@H](N)C(=O)O.C[Se]C[C@H](N)C(=O)O	None
AKRT014463	C[S+](C)CC[C@H](N)C(=O)O.N[C@@H](C[SeH])C(=O)O>>C[Se]C[C@H](N)C(=O)O	RXN-14164
AKRT014464	C[S+](C)CC[C@H](N)C(=O)O>>*[C@H](N)C(=O)O	RXN-9759
AKRT014465	C[S+](C)CC[C@H](N)C(=O)O>>CSC	enzymemap_64362
AKRT014466	C[S+](C)CC[C@H](N)C(=O)O>>CSCC[C@H](N)C(=O)O	MMUM-RXN
AKRT014467	C[S+](C)CC[C@H](N)C(=O)O>>C[S+](C)CCC(=O)C(=O)O	enzymemap_86132
AKRT014468	C[S+](C)CC[C@H](N)C(=O)O>>C[S+](C)CCCN	RXN-9756
AKRT014469	C[S+](C)CC[C@H](N)C(=O)O>>N[C@@H](CCO)C(=O)O	RXN-19156
AKRT014470	C[S+](C)CC[C@H](N)C(=O)O>>O=C=O	RXN-9756
AKRT014513	C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O>>C[S+](C)CC[C@H](N)C(=O)O	enzymemap_25800