BioLiP

PDB

BioLiP

PDB CCD ID:

MP9

Number of entries in BioLiP:

Chemical formula:

C14 H14 N6 O4

InChI:

InChI=1S/C14H14N6O4/c15-10(14(22)23)6-9-11(24-18-13(9)21)12-16-19-20(17-12)7-8-4-2-1-3-5-8/h1-5,10H,6-7,15H2,(H,18,21)(H,22,23)/t10-/m0/s1

InChIKey:

ZNMNDDBPIVAUGG-JTQLQIEISA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	c1ccc(cc1)Cn2nc(nn2)c3c(c(no3)O)C[C@@H](C(=O)O)N
ACDLabs 10.04	O=C(O)C(N)Cc1c(onc1O)c2nn(nn2)Cc3ccccc3
OpenEye OEToolkits 1.5.0	c1ccc(cc1)Cn2nc(nn2)c3c(c(no3)O)CC(C(=O)O)N
CACTVS 3.341	N[CH](Cc1c(O)noc1c2nnn(Cc3ccccc3)n2)C(O)=O
CACTVS 3.341	N[C@@H](Cc1c(O)noc1c2nnn(Cc3ccccc3)n2)C(O)=O

Name:

2-AMINO-3-[3-HYDROXY-5-(2-BENZYL-2H-5-TETRAZOLYL)-4-ISOXAZOLYL]-PROPIONIC ACID;
3-[5-(2-BENZYL-2H-TETRAZOL-5-YL)-3-HYDROXYISOXAZOL-4-YL]-L-ALANINE;
2-BN-TET-AMPA

ZINC:

ZINC000016052344

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).