BioLiP

PDB

BioLiP

PDB CCD ID:

3PM

Number of entries in BioLiP:

Chemical formula:

C7 H15 N O3

InChI:

InChI=1S/C7H15NO3/c1-7(2,3)11-4-5(8)6(9)10/h5H,4,8H2,1-3H3,(H,9,10)/t5-/m1/s1

InChIKey:

DDCPKNYKNWXULB-RXMQYKEDSA-N

SMILES:

Software	SMILES
ACDLabs 12.01	O=C(O)C(N)COC(C)(C)C
OpenEye OEToolkits 1.7.0	CC(C)(C)OC[C@H](C(=O)O)N
CACTVS 3.370	CC(C)(C)OC[CH](N)C(O)=O
CACTVS 3.370	CC(C)(C)OC[C@@H](N)C(O)=O
OpenEye OEToolkits 1.7.0	CC(C)(C)OCC(C(=O)O)N

Name:

O-tert-butyl-D-serine

ZINC:

ZINC000002168273

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).