BioLiP

PDB

BioLiP

PDB CCD ID:

FHP

Number of entries in BioLiP:

Chemical formula:

C15 H27 O4 P

InChI:

InChI=1S/C15H27O4P/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15(16)20(17,18)19/h7,9,11,15-16H,5-6,8,10H2,1-4H3,(H2,17,18,19)/b13-9+,14-11+/t15-/m1/s1

InChIKey:

MONZTFSZTWQCKH-UBHHKXJDSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	CC(=CCC/C(=C/CC/C(=C/[C@H](O)P(=O)(O)O)/C)/C)C
CACTVS 3.341	CC(C)=CCC/C(C)=C/CC/C(C)=C/[C@H](O)[P](O)(O)=O
OpenEye OEToolkits 1.5.0	CC(=CCCC(=CCCC(=CC(O)P(=O)(O)O)C)C)C
CACTVS 3.341	CC(C)=CCCC(C)=CCCC(C)=C[CH](O)[P](O)(O)=O
ACDLabs 10.04	O=P(O)(O)C(O)/C=C(/CC\C=C(/C)CC\C=C(/C)C)C

Name:

1-HYDROXY-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENE PHOSPHONIC ACID;
FARNESYL HYDROXYPHOSPHONATE

ZINC:

ZINC000001535663

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).