WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 558523
CAS#: 82-55-3
Description: Iboxygaine is discontinued (DEA controlled substance). It is a natural psychoactive substance used to ease withdrawal and prevent cravings.
MedKoo Cat#: 558523
Name: Iboxygaine
CAS#: 82-55-3
Chemical Formula: C20H26N2O2
Exact Mass: 326.2
Molecular Weight: 326.44
Elemental Analysis: C, 73.59; H, 8.03; N, 8.58; O, 9.80
Synonym: Iboxygaine; Kimvuline;
IUPAC/Chemical Name: (S)-1-((6R,6aR,7R,9S,11S)-2-methoxy-6,6a,7,8,9,10,12,13-octahydro-5H-6,9-methanopyrido[1',2':1,2]azepino[4,5-b]indol-7-yl)ethan-1-ol
InChi Key: QLSITYRYHBQHBY-BFRPBLBHSA-N
InChi Code: InChI=1S/C20H26N2O2/c1-11(23)15-7-12-8-17-19-14(5-6-22(10-12)20(15)17)16-9-13(24-2)3-4-18(16)21-19/h3-4,9,11-12,15,17,20-21,23H,5-8,10H2,1-2H3/t11-,12+,15-,17-,20-/m0/s1
SMILES Code: C[C@@H]([C@@H]1C[C@@]2([H])C[N@]3[C@]1([H])[C@](C2)([H])C(N4)=C(CC3)C5=C4C=CC(OC)=C5)O
1: Perera P, Samuelsson G, van Beek TA, Verpoorte R. Tertiary indole alkaloids from leaves of Tabernaemontana dichotoma. Planta Med. 1983 Mar;47(3):148-50. PubMed PMID: 17404903.
2: RENNER U, PRINS DA. [Voacanga alkaloids. III. Voacristine: identity with voacangarine and decomposition to iboxygaine and ibogaine]. Experientia. 1959 Dec 15;15:456-7. German. PubMed PMID: 14437366.