chempirical

N-Formylmethionine

C6H11NO3SCAS 4289-98-9177.22 g/mol

Open in Covalent MOL file
SNHOOOH
Carboxylic acidSulfide

Properties

Molecular formula
C6H11NO3S
Molar mass
177.22 g/mol
Exact mass
177.0460 Da
Melting point
100–101.5 °C
logP
0.78Crippen estimate
Polar surface area
69.9 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
4289-98-9
SMILES
CSCC[C@H](N=CO)C(=O)O
InChIKey
PYUSHNKNPOHWEZ-YFKPBYRVSA-N
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

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Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • L-Methionine, N-formyl-
  • Methionine, N-formyl-, L-
  • N-Formyl-L-methionine
  • Formylmethionine
  • L-N-Formylmethionine
  • Formyl-L-methionine
  • L-Formylmethionine
  • NSC 334322
  • (2S)-2-Formamido-4-(methylsulfanyl)butanoic acid

Work with N-Formylmethionine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Acetylmethionine1115-47-559 % similar N-Acetyl-D-methionine1509-92-859 % similar N-Acetyl-L-methionine65-82-759 % similar N-Formyl-L-leucine6113-61-755 % similar N-Formylmethionine-leucyl-phenylalanine59880-97-654 % similar 2-Hydroxy-4-(methylthio)butyric acid583-91-553 % similar N-Formyl-L-aspartic acid19427-28-253 % similar Dl-alanyl-dl-methionine1999-43-552 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-Formylmethionine4309-82-4 3-[[(Acetylamino)methyl]thio]propanoic acid52574-08-0 Alliin556-27-4

Elsewhere

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