Summary

IMPPAT Phytochemical identifier: IMPHY015813

Phytochemical name: DL-Methionine sulfone

Synonymous chemical names:
methionine sulfone

External chemical identifiers:
CID:69961, ChEBI:132188, FDASRS:5503K54L0R, SureChEMBL:SCHEMBL204462, MolPort-001-792-295

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Chemical structure information

SMILES:
OC(=O)C(CCS(=O)(=O)C)N

InChI:
InChI=1S/C5H11NO4S/c1-11(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)

InChIKey:
UCUNFLYVYCGDHP-UHFFFAOYSA-N

DeepSMILES:
OC=O)CCCS=O)=O)C))))N

Functional groups:
CC(=O)O, CN, CS(C)(=O)=O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Carboxylic acids and derivatives

ClassyFire Subclass: Amino acids, peptides, and analogues

NP Classifier Biosynthetic pathway: Amino acids and Peptides

NP Classifier Superclass: Small peptides

NP Classifier Class: Aminoacids

NP-Likeness score: 0.155

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Chemical structure download