acompound

Showing entry for Phosphatidylcholine

General Compound Information
BXGC Id	BXGC0010636
Compound Name	Phosphatidylcholine
Structure
Formula	C42H82NO8P
InchiKey	WTJKGGKOPKCXLL-VYOBOKEXSA-N
SMILES	CCCCCCCCCCCCCCCC(=O)OC[C@]([H])(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCC\C=C/CCCCCCCC
Inchi	InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m1/s1
IUPAC	(2-{[(2R)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl phosphono]oxy}ethyl)trimethylazanium
Molecular Weight	760.08
Pubchem Id	5497103
Chembl Id

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

LBN

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
O75762	BXGT005151	Transient receptor potential cation channel subfamily A member 1	reviewed	TRPA1	Ion channel	-	-	-	-
Q16611	BXGT013644	Bcl-2 homologous antagonist/killer	reviewed	BAK1	Signaling	-	-	-	-

Binding DB

n.a

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

CHEMBL

n.a

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

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00016	Peanut	Arachis hypogaea	Nuts
BXGF00024	Brazil nut	Bertholletia excelsa	Nuts
BXGF00065	Cucumber	Cucumis sativus	Gourds
BXGF00072	Wild carrot	Daucus carota	Vegetables
BXGF00079	Common buckwheat	Fagopyrum esculentum	Cereals and cereal products
BXGF00081	Fig	Ficus carica	Fruits
BXGF00085	Soy bean	Glycine max	Soy
BXGF00086	Sunflower	Helianthus annuus	Herbs and Spices
BXGF00094	Common walnut	Juglans regia	Nuts
BXGF00101	Flaxseed	Linum usitatissimum	Herbs and Spices
BXGF00105	Apple	Malus pumila	Fruits
BXGF00125	Rice	Oryza sativa	Cereals and cereal products
BXGF00130	Avocado	Persea americana	Vegetables
BXGF00141	Common pea	Pisum sativum	Pulses
BXGF00142	Purslane	Portulaca oleracea	Herbs and Spices
BXGF00147	European plum	Prunus domestica	Fruits
BXGF00151	Pomegranate	Punica granatum	Fruits
BXGF00170	Sesame	Sesamum orientale	Herbs and Spices
BXGF00178	Spinach	Spinacia oleracea	Vegetables
BXGF00181	Dandelion	Taraxacum officinale	Herbs and Spices
BXGF00182	Cocoa bean	Theobroma cacao	Cocoa and cocoa products
BXGF00186	Fenugreek	Trigonella foenum-graecum	Herbs and Spices
BXGF00187	Common wheat	Triticum aestivum	Cereals and cereal products
BXGF00199	Gram bean	Vigna mungo	Pulses
BXGF00204	Common grape	Vitis vinifera	Fruits
BXGF00205	Corn	Zea mays	Cereals and cereal products
BXGF00206	Ginger	Zingiber officinale	Herbs and Spices
BXGF00230	Carrot	Daucus carota ssp. sativus	Vegetables
BXGF00370	White lupine	Lupinus albus	Pulses
BXGF00402	Opium poppy	Papaver somniferum	Herbs and Spices
BXGF00506	Shiitake	Lentinus edodes	Vegetables
BXGF00802	Soft-necked garlic	Allium sativum L. var. sativum	Herbs and Spices

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}