acompound

Showing entry for Trilinolein

General Compound Information
BXGC Id	BXGC0047510
Compound Name	Trilinolein
Structure
Formula	C57H98O6
InchiKey	HBOQXIRUPVQLKX-BBWANDEASA-N
SMILES	CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCC/C=C\C/C=C\CCCCC
Inchi	InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-21,25-30,54H,4-15,22-24,31-53H2,1-3H3/b19-16-,20-17-
IUPAC	2,3-bis[[(9Z,12Z)-octadeca-9,12-dienoyl]oxy]propyl (9Z,12Z)-octadeca-9,12-dienoate
Molecular Weight	878.74
Pubchem Id	5322095
Chembl Id	CHEMBL3343985

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1

Binding DB

50192745

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
reviewed	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	-	8400	-	-

CHEMBL

CHEMBL3343985

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	IC50	'='	8400	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00094	Common walnut	Juglans regia	Nuts
BXGF00959	Artemisia hanseniana	Artemisia hanseniana	Others
BXGF01159	Kopsia grandifolia	Kopsia grandifolia	Others
BXGF01281	Ledebouria socialis	Ledebouria socialis	Others
BXGF01361	Lycopus europaeus	Lycopus europaeus	Medicinal Plant
BXGF01400	Dipterocarpus dyeri	Dipterocarpus dyeri	Others
BXGF01518	Ipomoea cairica	Ipomoea cairica	Medicinal Plant
BXGF01699	Ceanothus velutinus	Ceanothus velutinus	Medicinal Plant
BXGF01732	Garcinia scortechinii	Garcinia scortechinii	Others
BXGF01756	Apollonias barbujana	Apollonias barbujana	Others
BXGF01781	Chlorophytum borivilianum	Chlorophytum borivilianum	Medicinal Plant
BXGF02316	Isodon lophanthoides	Isodon lophanthoides	Medicinal Plant
BXGF02596	Fragaria vesca	Fragaria vesca	Medicinal Plant
BXGF03004	Pinus monophylla	Pinus monophylla	Medicinal Plant
BXGF03046	Cynanchum formosanum	Cynanchum formosanum	Others
BXGF03090	Lasianthus fordii	Lasianthus fordii	Others
BXGF03348	Panax notoginseng	Panax notoginseng	Medicinal Plant
BXGF03847	Thermopsis mollis	Thermopsis mollis	Others
BXGF04430	Crinum latifolium	Crinum latifolium	Medicinal Plant
BXGF05073	Alnus cordata	Alnus cordata	Human Edible Plant
BXGF05096	Aconitum leucostomum	Aconitum leucostomum	Medicinal Plant
BXGF05200	Aquilegia ecalcarata	Aquilegia ecalcarata	Medicinal Plant
BXGF05308	Aloe deltoideodonta	Aloe deltoideodonta	Others
BXGF05316	Persea mexicana	Persea mexicana	Others
BXGF05501	Bauhinia purpurea	Bauhinia purpurea	Medicinal Plant
BXGF05767	Gardenia tubifera	Gardenia tubifera	Medicinal Plant
BXGF05845	Panax innovans	Panax innovans	Others
BXGF05956	Blumea mollis	Blumea mollis	Medicinal Plant
BXGF05960	Leitneria floridana	Leitneria floridana	Others
BXGF06070	Perilla frutescens	Perilla frutescens	Medicinal Plant
BXGF06124	Notholaena aschenborniana	Notholaena aschenborniana	Others

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}