SEQ2FUN

BioLiP

PDB CCD ID: MAS
Number of entries in BioLiP: 0
Chemical formula: C2 H7 N O3 S
InChI: InChI=1S/C2H7NO3S/c1-3(2)7(4,5)6/h1-2H3,(H,4,5,6)
InChIKey: YGNOYUCUPMACDT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0CN(C)S(=O)(=O)O
CACTVS 3.370CN(C)[S](O)(=O)=O
ACDLabs 12.01O=S(=O)(O)N(C)C
Name:dimethylsulfamic acid
ChEMBL: CHEMBL1161203
ZINC: ZINC000004722957
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).