BioLiP

PDB

BioLiP

PDB CCD ID:

3V2

Number of entries in BioLiP:

Chemical formula:

C3 H10 N O3 P

InChI:

InChI=1S/C3H10NO3P/c1-2-3(4)8(5,6)7/h3H,2,4H2,1H3,(H2,5,6,7)/t3-/m1/s1

InChIKey:

DELJNDWGTWHHFA-GSVOUGTGSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.9.2	CC[C@H](N)P(=O)(O)O
ACDLabs 12.01	O=P(O)(O)C(N)CC
OpenEye OEToolkits 1.9.2	CCC(N)P(=O)(O)O
CACTVS 3.385	CC[CH](N)[P](O)(O)=O
CACTVS 3.385	CC[C@H](N)[P](O)(O)=O

Name:

[(1R)-1-aminopropyl]phosphonic acid

ZINC:

ZINC000002146774

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).