Benzoylecgonine
cas: 519-09-5 — see every product listed under this CAS number, including other names
Benzoylecgonine (CAS 519-09-5) is a chemical reagent available from Chemat. Available pack sizes: 25mg, 50mg, 100mg, 10mg. Offered by: Mikromol, Lipomed, LoGiCal.
| brand | Mikromol |
|---|---|
| catalog number | MM1345.04-0025 |
| cas | 519-09-5 |
| size | 25mg |
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Available pack sizes
| brand | size | price | |
|---|---|---|---|
| Mikromol | 25mg | price on request | |
| Lipomed | 50mg | price on request | |
| Lipomed | 100mg | price on request | |
| Lipomed | 10mg | price on request | |
| LoGiCal | 10mg | price on request |
properties
| purity | No data |
|---|---|
| delivery time | To be confirmed by Chemat |
Ecgonine benzoate is a benzoate ester metabolite of cocaine formed by hydrolysis of the methyl ester group, catalysed by carboxylesterases. It has a role as an epitope, a plant metabolite, a human xenobiotic metabolite and a marine xenobiotic metabolite. It is a benzoate ester and a tropane alkaloid. It is functionally related to an ecgonine.
Source: ChEBI
| Molecular formula | C16H19NO4 |
|---|---|
| Molecular weight | 289.33 g/mol |
| IUPAC name | (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid |
| InChIKey | GVGYEFKIHJTNQZ-RFQIPJPRSA-N |
| SMILES | CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)C3=CC=CC=C3)C(=O)O |
Computed by PubChem (NCBI)
Synonyms:
benzoylecgonine, Ecgonine benzoate, (-)-Benzoylecgonine, o-Benzoyl-(-)-ecgonine, benzoyl ecgonine, (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-azabicyclo(3.2.1)octane-2-carboxylic acid, (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid, (2R,3S)-3-(benzoyloxy)-8-methyl-8-azabicyclo(3.2.1)octane-2-carboxylic acid, (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-azoniabicyclo(3.2.1)octane-2-carboxylate, O-Benzoylecgonine