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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

BioLiP

PDB CCD ID: ZZJ
Number of entries in BioLiP: 0
Chemical formula: C4 H10 N2 O
InChI: InChI=1S/C4H10N2O/c1-3(6-2)4(5)7/h3,6H,1-2H3,(H2,5,7)/t3-/m0/s1
InChIKey: QKNFFJHHPCWXTH-VKHMYHEASA-N
SMILES:
SoftwareSMILES
CACTVS 3.352CN[CH](C)C(N)=O
CACTVS 3.352CN[C@@H](C)C(N)=O
ACDLabs 10.04O=C(N)C(NC)C
OpenEye OEToolkits 1.6.1CC(C(=O)N)NC
OpenEye OEToolkits 1.6.1C[C@@H](C(=O)N)NC
Name:N^2^-methyl-L-alaninamide
ZINC: ZINC000020307999

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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