BioLiP

PDB

BioLiP

PDB CCD ID:

HYP

Number of entries in BioLiP:

Chemical formula:

C5 H9 N O3

InChI:

InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/m1/s1

InChIKey:

PMMYEEVYMWASQN-DMTCNVIQSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C1C(CNC1C(=O)O)O
OpenEye OEToolkits 1.5.0	C1[C@H](CN[C@@H]1C(=O)O)O
CACTVS 3.341	O[CH]1CN[CH](C1)C(O)=O
CACTVS 3.341	O[C@H]1CN[C@@H](C1)C(O)=O
ACDLabs 10.04	O=C(O)C1NCC(O)C1

Name:

4-HYDROXYPROLINE;
HYDROXYPROLINE

ChEMBL:

CHEMBL352418

DrugBank:

DB08847

ZINC:

ZINC000000901791

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).