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BioLiP

PDB CCD ID: AME
Number of entries in BioLiP: 19
Chemical formula: C7 H13 N O3 S
InChI: InChI=1S/C7H13NO3S/c1-5(9)8-6(7(10)11)3-4-12-2/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)/t6-/m0/s1
InChIKey: XUYPXLNMDZIRQH-LURJTMIESA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0CC(=O)NC(CCSC)C(=O)O
OpenEye OEToolkits 1.5.0CC(=O)N[C@@H](CCSC)C(=O)O
ACDLabs 10.04O=C(NC(C(=O)O)CCSC)C
CACTVS 3.341CSCC[C@H](NC(C)=O)C(O)=O
CACTVS 3.341CSCC[CH](NC(C)=O)C(O)=O
Name:N-ACETYLMETHIONINE
DrugBank: DB01646
ZINC: ZINC000001529501
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L 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).

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