BioLiP

PDB

BioLiP

PDB CCD ID:

DPH

Number of entries in BioLiP:

Chemical formula:

C10 H12 O2

InChI:

InChI=1S/C10H12O2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12)/t8-/m0/s1

InChIKey:

MCIIDRLDHRQKPH-QMMMGPOBSA-N

SMILES:

Software	SMILES
CACTVS 3.341	C[CH](Cc1ccccc1)C(O)=O
OpenEye OEToolkits 1.5.0	CC(Cc1ccccc1)C(=O)O
OpenEye OEToolkits 1.5.0	C[C@@H](Cc1ccccc1)C(=O)O
CACTVS 3.341	C[C@@H](Cc1ccccc1)C(O)=O
ACDLabs 10.04	O=C(O)C(C)Cc1ccccc1

Name:

DEAMINO-METHYL-PHENYLALANINE

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).