BioLiP

PDB

BioLiP

PDB CCD ID:

C4L

Number of entries in BioLiP:

Chemical formula:

C8 H15 N O4

InChI:

InChI=1S/C8H15NO4/c1-2-3-7(11)9-6(4-5-10)8(12)13/h6,10H,2-5H2,1H3,(H,9,11)(H,12,13)/t6-/m0/s1

InChIKey:

FWULQXYJOANGSS-LURJTMIESA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.7.6	CCCC(=O)NC(CCO)C(=O)O
ACDLabs 12.01	O=C(NC(C(=O)O)CCO)CCC
OpenEye OEToolkits 1.7.6	CCCC(=O)N[C@@H](CCO)C(=O)O
CACTVS 3.370	CCCC(=O)N[CH](CCO)C(O)=O
CACTVS 3.370	CCCC(=O)N[C@@H](CCO)C(O)=O

Name:

N-butanoyl-L-homoserine

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).