Ecgonine
(1R,2R,3S,5S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid
Also Known As: Ecgonine|1-Ecgonine|(-)-Ecgonine|Ekgonin|DL-Ecgonine|ecgonin|L-ecgonine|(+/-)-Ecgonine|Ecgonine, (+/-)-|ECGONINE [MI]|Ecgonine (6CI,7CI)|Ecgonine (+/-)-form [MI]|ECGONINE [WHO-DD]|IDS-NE-001|Cocaine precusor in Coca leaves|DEA No. 9180|EINECS 207-565-4|3beta-Hydroxy-2beta-tropanecarboxylic acid|3 beta-hydroxy-2 beta-tropanecarboxylic acid|(1R,2R,3S,5S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid|ECGONINE HYDROCHLORIDE AMINO ALCOHOL POR TION|3beta-hydroxy-1alphaH,5alphaH-tropane-2beta-carboxylic acid|1alphaH,5alphaH-Tropane-2beta-carboxylic acid, 3-beta-hydroxy-|3.BETA.-HYDROXY-2.BETA.-TROPANECARBOXYLIC ACID|8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-hydroxy-8-methyl-, (1R-(exo,exo))-|8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-hydroxy-8-methyl-, monohydrate, (exo,exo)-
| Molecular Formula | C9H15NO3 |
|---|---|
| Molecular Weight | 185.1052 g/mol |
| LogP | -0.09 |
| Topological Polar Surface Area | 60.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 185.1052 |
| Heavy Atoms | 13 |
| Complexity | 230.9 |
Chemical Identifiers
| CAS Number | 481-37-8 |
|---|---|
| SMILES | CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)O)C(=O)O |
Product Overview
Ecgonine (CAS 481-37-8), with molecular formula C9H15NO3 and molecular weight 185.1052 g/mol. IUPAC: (1R,2R,3S,5S)-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid.
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