Marvin  05130818202D          

 12 11  0  0  1  0            999 V2000
   -0.7145    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.4125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    1.6499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1433    0.4124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.8250    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    0.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0002   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  3  7  1  0  0  0  0
  3  4  1  1  0  0  0
  4  5  1  0  0  0  0
  5 12  2  0  0  0  0
  5  6  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  1  0  0  0  0
M  END
> <ID>
CHEBI:16552

> <NAME>
N-formyl-L-methionine

> <DEFINITION>
A L-methionine derivative in which one of the hydrogens attached to the nitrogen is replaced by a formyl group.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:21714; CHEBI:7279; CHEBI:5153; CHEBI:12506

> <SYNONYM>
N-formylmethionine; N-Formyl-L-methionine; Formyl-methionine; (2S)-2-(formylamino)-4-(methylthio)butanoic acid

> <IUPAC_NAME>
N-formyl-L-methionine; (2S)-2-formamido-4-(methylsulfanyl)butanoic acid

> <FORMULA>
C6H11NO3S

> <MASS>
177.22248

> <MONOISOTOPIC_MASS>
177.04596

> <CHARGE>
0

> <SMILES>
[H]C(=O)N[C@@H](CCSC)C(O)=O

> <INCHI>
InChI=1S/C6H11NO3S/c1-11-3-2-5(6(9)10)7-4-8/h4-5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1

> <INCHIKEY>
PYUSHNKNPOHWEZ-YFKPBYRVSA-N

> <CAS_REGISTRY_NUMBER>
4289-98-9

> <REAXYS_REGISTRY_NUMBER>
1725218

> <CHEMIDPLUS>
4289-98-9

> <DRUGBANK_ACCESSION>
DB04464

> <KEGG_COMPOUND_ACCESSION>
C03145

> <METACYC_ACCESSION>
N-FORMYLMETHIONINE

> <PDBECHEM_ACCESSION>
FME

> <WIKIPEDIA_ACCESSION>
Formylmethionine

> <PUBMED_CITATION>
22770225

$$$$