BioLiP

PDB

BioLiP

PDB CCD ID:

FCN

Number of entries in BioLiP:

Chemical formula:

C3 H7 O4 P

InChI:

InChI=1S/C3H7O4P/c1-2-3(7-2)8(4,5)6/h2-3H,1H3,(H2,4,5,6)/t2-,3+/m0/s1

InChIKey:

YMDXZJFXQJVXBF-STHAYSLISA-N

SMILES:

Software	SMILES
CACTVS 3.341	C[C@@H]1O[C@@H]1[P](O)(O)=O
OpenEye OEToolkits 1.5.0	C[C@H]1[C@H](O1)P(=O)(O)O
ACDLabs 10.04	O=P(O)(O)C1OC1C
OpenEye OEToolkits 1.5.0	CC1C(O1)P(=O)(O)O
CACTVS 3.341	C[CH]1O[CH]1[P](O)(O)=O

Name:

FOSFOMYCIN;
1,2-EPOXYPROPYLPHOSPHONIC ACID

ChEMBL:

CHEMBL1757

DrugBank:

DB00828

ZINC:

ZINC000001530427

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).