BioLiP

PDB

BioLiP

PDB CCD ID:

MME

Number of entries in BioLiP:

Chemical formula:

C6 H13 N O2 S

InChI:

InChI=1S/C6H13NO2S/c1-7-5(6(8)9)3-4-10-2/h5,7H,3-4H2,1-2H3,(H,8,9)/t5-/m0/s1

InChIKey:

YAXAFCHJCYILRU-YFKPBYRVSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	CN[C@@H](CCSC)C(=O)O
ACDLabs 10.04	O=C(O)C(NC)CCSC
OpenEye OEToolkits 1.5.0	CNC(CCSC)C(=O)O
CACTVS 3.341	CN[CH](CCSC)C(O)=O
CACTVS 3.341	CN[C@@H](CCSC)C(O)=O

Name:

N-METHYL METHIONINE

ChEMBL:

CHEMBL48185

Reference:

Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).

Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).