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BioLiP

PDB CCD ID: X60
Number of entries in BioLiP: 0
Chemical formula: C7 H15 N O2
InChI: InChI=1S/C7H15NO2/c1-3-5-7(8,4-2)6(9)10/h3-5,8H2,1-2H3,(H,9,10)/t7-/m0/s1
InChIKey: LBGMPMJSIJSELV-ZETCQYMHSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385CCC[C](N)(CC)C(O)=O
OpenEye OEToolkits 2.0.7CCCC(CC)(C(=O)O)N
CACTVS 3.385CCC[C@@](N)(CC)C(O)=O
OpenEye OEToolkits 2.0.7CCC[C@@](CC)(C(=O)O)N
ACDLabs 12.01CCCC(N)(CC)C(=O)O
Name:2-ethyl-L-norvaline
ZINC: ZINC000006381097
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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