BioLiP

PDB

BioLiP

PDB CCD ID:

KPH

Number of entries in BioLiP:

Chemical formula:

C5 H15 N2 O3 P

InChI:

InChI=1S/C5H15N2O3P/c6-4-2-1-3-5(7)11(8,9)10/h5H,1-4,6-7H2,(H2,8,9,10)/t5-/m1/s1

InChIKey:

LKFHLBGDPDYWSG-RXMQYKEDSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C(CCN)CC(N)P(=O)(O)O
OpenEye OEToolkits 1.5.0	C(CCN)C[C@H](N)P(=O)(O)O
ACDLabs 10.04	O=P(O)(O)C(N)CCCCN
CACTVS 3.341	NCCCC[C@H](N)[P](O)(O)=O
CACTVS 3.341	NCCCC[CH](N)[P](O)(O)=O

Name:

[(1R)-1,5-diaminopentyl]phosphonic acid

ZINC:

ZINC000005410581

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).