Hydroxytropacocaine

Hydroxytropacocaine is a tropane alkaloid found in Erythroxylum coca.[1]

Hydroxytropacocaine
Names
IUPAC name
1-Hydroxy-8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl benzoate
Identifiers
CAS Number
3D model (JSmol)
ChemSpider
PubChem CID
InChI
  • InChI=1S/C15H19NO3/c1-16-12-7-8-15(16,18)10-13(9-12)19-14(17)11-5-3-2-4-6-11/h2-6,12-13,18H,7-10H2,1H3/t12-,13-,15-/m1/s1 Y
    Key: XJPJWHPAEMZDER-UMVBOHGHSA-N Y
  • InChI=1/C15H19NO3/c1-16-12-7-8-15(16,18)10-13(9-12)19-14(17)11-5-3-2-4-6-11/h2-6,12-13,18H,7-10H2,1H3/t12-,13-,15-/m1/s1
    Key: XJPJWHPAEMZDER-UMVBOHGHBB
SMILES
  • O=C(O[C@@H]1C[C@@H]2N(C)[C@](O)(C1)CC2)c3ccccc3
Properties
Chemical formula
 C15H19NO3
Molar mass 261.32 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Y verify (what is YN ?)
Infobox references

See also
  • Coca alkaloids

References
  1. John R. Malpass and Anna L. Wallis (1998). "Total synthesis of 1-hydroxytropacocaine and analogues". Tetrahedron. 54 (14): 3631–3644. doi:10.1016/S0040-4020(98)00095-7.
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