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Substance Name: Ibogaine hydrochloride
RN: 5934-55-4
UNII: MRI8GKD98X
InChIKey: IKJFDJLQPHDRTD-ISYVNWANSA-N

Note

  • One of several indole alkaloids extracted from Tabernanthe iboga, Baill. It has a complex pharmacological profile, and interacts with multiple systems of neurotransmission. Ibogaine has psychoactive properties and appears to modulate tolerance to opiates.

Molecular Formula

  • C20-H26-N2-O.Cl-H

Molecular Weight

  • 346.8993
 

Classification Codes

  • Excitatory Amino Acid Antagonists
  • Hallucinogens
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Names and Synonyms

Name of Substance

  • Ibogaine hydrochloride

Synonyms

  • dl-Ibogamine hydrochloride
  • EINECS 227-687-1
  • IBOGAINE (HCL)
  • Ibogaine hydrochloride
  • Ibogaine hydrochloride (VAN)
  • Ibogamine, 12-methoxy-, monohydrochloride
  • NSC 29847
  • UNII-MRI8GKD98X

Systematic Names

  • 12-Methoxyibogamine monohydrochloride
  • Ibogaine, monohydrochloride
  • Ibogamine, 12-methoxy-, monohydrochloride (9CI)

Registry Numbers

CAS Registry Number

  • 5934-55-4

FDA UNII

  • MRI8GKD98X

System Generated Number

  • 0005934554

Molecular Formulas

Molecular Formula

  • C20-H26-N2-O.Cl-H

Molecular Formula Fragments

  • C20-H26-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H26N2O.ClH/c1-3-13-8-12-9-17-19-15(6-7-22(11-12)20(13)17)16-10-14(23-2)4-5-18(16)21-19;/h4-5,10,12-13,17,20-21H,3,6-9,11H2,1-2H3;1H/t12-,13+,17+,20+;/m1./s1

InChIKey

IKJFDJLQPHDRTD-ISYVNWANSA-N

Smiles

Cl.CC[C@H]1C[C@@H]2C[C@@H]3[C@H]1N(CCc4c3[nH]c5ccc(OC)cc45)C2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00618,
rat LD50 oral 482mg/kg (482mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Toxicologist. Vol. 14, Pg. 221, 1994.
rat LDLo intraperitoneal 254mg/kg (254mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Toxicologist. Vol. 14, Pg. 221, 1994.