Ligand name: (3~{E},5~{Z},7~{E},9~{R},10~{S},11~{E},13~{E},15~{E},17~{R},18~{S},20~{S})-20-[(1~{R})-1-[(2~{S},3~{R},4~{R},5~{S},6~{R})-5-[(2~{S},4~{S},5~{S},6~{R})-5-[(2~{S},4~{R},5~{R},6~{R})-4,6-dimethyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-6-methyl-4-oxidanyl-oxan-2-yl]oxy-3-methoxy-6-(3-methoxypropyl)-5-methyl-2,4-bis(oxidanyl)oxan-2-yl]ethyl]-5,18-dimethoxy-3,7,9,11,13,15-hexamethyl-10-[(2~{R},3~{S},4~{R},5~{R},6~{S})-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-17-oxidanyl-1-oxacycloicosa-3,5,7,11,13,15-hexaen-2-one
PDB ligand accession: ZHD
DrugBank: n/a
PubChem: 156026030
ChEMBL: n/a
InChI Key: QVIWDCUKIZPUBD-RSDTUZBPSA-N
SMILES: CC1C=C(C=C(C=C(C(=O)OC(CC(C(C=C(C=C(C=C(C1OC2C(C(C(C(O2)C)O)O)O)C)C)C)O)OC)C(C)C3(C(C(C(C(O3)CCCOC)(C)OC4CC(C(C(O4)C)OC5CC(C(C(O5)C)O)(C)O)O)O)OC)O)C)OC)C
Drug action: n/a

ClassyFire chemical classification:

List of PDB structures and/or AlphaFold models with target protein A0A6A5Q493

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
7MD2 Download Experimental e7md2A2
e7md2D2
e7md2G1
e7md2C2
e7md2F2
C-terminal domain of alpha and beta subunits of F1 ATP synthase
C-terminal domain of alpha and beta subunits of F1 ATP synthase
ATP synthase (F1-ATPase), gamma subunit
C-terminal domain of alpha and beta subunits of F1 ATP synthase
C-terminal domain of alpha and beta subunits of F1 ATP synthase
LigPlot