BioLiP

PDB

BioLiP

PDB CCD ID:

ZEZ

Number of entries in BioLiP:

Chemical formula:

C10 H13 N5 O

InChI:

InChI=1S/C10H13N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h2,5-6,16H,3-4H2,1H3,(H2,11,12,13,14,15)/b7-2-

InChIKey:

UZKQTCBAMSWPJD-UQCOIBPSSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	CC(=CCNc1c2c([nH]cn2)ncn1)CO
ACDLabs 10.04	n2c1c(ncn1)c(nc2)NC/C=C(/C)CO
CACTVS 3.341	CC(CO)=CCNc1ncnc2[nH]cnc12
CACTVS 3.341	C\C(CO)=C\CNc1ncnc2[nH]cnc12
OpenEye OEToolkits 1.5.0	C/C(=C/CNc1c2c([nH]cn2)ncn1)/CO

Name:

(2Z)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol;
CIS-ZEATIN

ZINC:

ZINC000013523718

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).