BioLiP

PDB

BioLiP

PDB CCD ID:

FC0

Number of entries in BioLiP:

Chemical formula:

C10 H11 N O4

InChI:

InChI=1S/C10H11NO4/c12-9(13)8(11-10(14)15)6-7-4-2-1-3-5-7/h1-5,8,11H,6H2,(H,12,13)(H,14,15)/t8-/m0/s1

InChIKey:

XXGPNEDZNRZWPK-QMMMGPOBSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.6.1	c1ccc(cc1)C[C@@H](C(=O)O)NC(=O)O
OpenEye OEToolkits 1.6.1	c1ccc(cc1)CC(C(=O)O)NC(=O)O
CACTVS 3.352	OC(=O)N[CH](Cc1ccccc1)C(O)=O
ACDLabs 10.04	O=C(O)C(NC(=O)O)Cc1ccccc1
CACTVS 3.352	OC(=O)N[C@@H](Cc1ccccc1)C(O)=O

Name:

N-CARBOXY-L-PHENYLALANINE

ZINC:

ZINC000034175426

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).