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Substance Name: Pseudococaine sodium tartrate
RN: 67465-00-3
UNII: 757O941EON
InChIKey: QMIQMCQMQRKRCG-RUVAMWTBSA-M

Molecular Formula

  • C17-H21-N-O4.C4-H5-O6.Na

Molecular Weight

  • 475.4234
 
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Names and Synonyms

Name of Substance

  • Pseudococaine sodium tartrate

Synonyms

  • (1R,2S,3S,5S)-3-(Benzoyloxy)-8-methyl-8-azabicyclo(3.2.1)octane-2-carboxylic acid methyl ester sodium tartrate
  • 8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, (1R,2S,3S,5S)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1), monosodium salt
  • Pseudococaine sodium tartrate
  • Pseudococaine sodium tartrate [MI]
  • Psicaine N
  • UNII-757O941EON

Registry Numbers

CAS Registry Number

  • 67465-00-3

FDA UNII

  • 757O941EON

System Generated Number

  • 0067465003

Structure Descriptors

InChI

1S/C17H21NO4.C4H6O6.Na/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11;5-1(3(7)8)2(6)4(9)10;/h3-7,12-15H,8-10H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10);/q;;+1/p-1/t12-,13+,14-,15-;1-,2-;/m01./s1

InChIKey

QMIQMCQMQRKRCG-RUVAMWTBSA-M

Smiles

CN1[C@H]2CC[C@@H]1[C@@H]([C@H](C2)OC(=O)c3ccccc3)C(=O)OC.[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O.[Na+]