Tembetarine

CAS Registry Number®

18446-73-6

CAS Name

Tembetarine

Molecular Formula

C20H26NO4

Cite this Page

Tembetarine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=18446-73-6 (retrieved 2025-01-05) (CAS RN: 18446-73-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H25NO4/c1-21(2)8-7-14-11-20(25-4)18(23)12-15(14)16(21)9-13-5-6-19(24-3)17(22)10-13/h5-6,10-12,16H,7-9H2,1-4H3,(H-,22,23)/p+1/t16-/m0/s1

InChIKey

InChIKey=ABSDACFLIMOXJY-INIZCTEOSA-O

SMILES

C([C@H]1C=2C(=CC(OC)=C(O)C2)CC[N+]1(C)C)C3=CC(O)=C(OC)C=C3

Canonical SMILES

OC1=CC(=CC=C1OC)CC2C3=CC(O)=C(OC)C=C3CC[N+]2(C)C

Other Names for this Substance

  • Isoquinolinium, 1,2,3,4-tetrahydro-7-hydroxy-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2,2-dimethyl-, (1S)-
  • Tembetarine
  • Isoquinolinium, 1,2,3,4-tetrahydro-7-hydroxy-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2,2-dimethyl-, (S)-
  • (1S)-1,2,3,4-Tetrahydro-7-hydroxy-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2,2-dimethylisoquinolinium
  • (+)-Tembetarine

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