Benzoylecgonine

Benzoylecgonine
Names
	IUPAC name 3β-(Benzoyloxy)tropane-2β-carboxylic acid
	Systematic IUPAC name (1R,2R,3S,5S)-3-(Benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid
Identifiers
CAS Number	519-09-5 ;
3D model (JSmol)	Interactive image;
Beilstein Reference	89637
ChEBI	CHEBI:41001 ;
ChemSpider	395095 ;
DrugBank	DB01515 ;
ECHA InfoCard	100.007.513
EC Number	208-263-5;
KEGG	C10847 ;
PubChem CID	448223;
UNII	5353I8I6YS ;
CompTox Dashboard (EPA)	DTXSID7046758 ;
	InChI InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)/t11-,12+,13-,14+/m0/s1 Key: GVGYEFKIHJTNQZ-RFQIPJPRSA-N ; InChI=1/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)/t11-,12+,13-,14+/m0/s1 Key: GVGYEFKIHJTNQZ-RFQIPJPRBD;
	SMILES CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)c3ccccc3)C(=O)O;
Properties
Chemical formula	C16H19NO4
Molar mass	289.331 g·mol−1
Hazards
	GHS labelling:
Pictograms
Signal word	Danger
Hazard statements	H301
Precautionary statements	P264, P270, P301+P310, P321, P330, P405, P501
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). verify (what is ?) Infobox references

Benzoylecgonine is the main metabolite of cocaine, formed by the liver and excreted in the urine. It is the compound tested for in most cocaine urine drug screens and in wastewater screenings for cocaine use.