acompound

Showing entry for N-Heptane

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0003334
Compound Name	N-Heptane
Structure
Formula	C7H16
InchiKey	IMNFDUFMRHMDMM-UHFFFAOYSA-N
SMILES	CCCCCCC
Inchi	InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3
IUPAC	heptane
Molecular Weight	100.2
Pubchem Id	8900
Chembl Id	CHEMBL134658

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

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
P81402	BXGT011948	Non-specific lipid-transfer protein 1	reviewed		-	-	-	-	-
P0A334	BXGT007007	pH-gated potassium channel KcsA	reviewed	kcsA	-	-	-	-	-
Q9K597	BXGT020876	Membrane protein	unreviewed	ompC	-	-	-	-	-
P35775	BXGT009865	Venom allergen 2	reviewed		-	-	-	-	-
P02945	BXGT005997	Bacteriorhodopsin	reviewed	bop	-	-	-	-	-
B0R5N9	BXGT001849	Bacteriorhodopsin	unreviewed	bop	-	-	-	-	-
P08191	BXGT006743	Type 1 fimbrin D-mannose specific adhesin	reviewed	fimH	-	-	-	-	-

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

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
BXGF00074	Cardamom	Elettaria cardamomum	Herbs and Spices
BXGF00206	Ginger	Zingiber officinale	Herbs and Spices
BXGF01140	Angelica gigas	Angelica gigas	Medicinal Plant
BXGF02049	Angelica sinensis	Angelica sinensis	Medicinal Plant
BXGF02131	Glycyrrhiza	Glycyrrhiza	Medicinal Plant
BXGF03164	Patrinia scabiosifolia	Patrinia scabiosifolia	Medicinal Plant
BXGF03735	Hansenia weberbaueriana	Hansenia weberbaueriana	Others
BXGF03865	Hansenia forbesii	Hansenia forbesii	Others
BXGF04659	Phyllanthus emblica	Phyllanthus emblica	Medicinal Plant
BXGF04842	Angelica acutiloba	Angelica acutiloba	Medicinal Plant
BXGF04900	Ostericum grosseserratum	Ostericum grosseserratum	Human Edible Plant
BXGF05140	Amomum neoaurantiacum	Amomum neoaurantiacum	Others
BXGF05863	Allium azureum ledeb	Allium azureum ledeb	Others
BXGF06148	Patrinia villosa	Patrinia villosa	Medicinal Plant

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}