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Details

Stereochemistry ACHIRAL
Molecular Formula C22H25NO2.BrH
Molecular Weight 416.351
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LOBELANINE HYDROBROMIDE

SMILES

Br.CN1[C@@H](CC(=O)C2=CC=CC=C2)CCC[C@H]1CC(=O)C3=CC=CC=C3

InChI

InChIKey=PCYYDKKPRFAMNI-AMDBCLDASA-N
InChI=1S/C22H25NO2.BrH/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18;/h2-7,9-12,19-20H,8,13-16H2,1H3;1H/t19-,20+;

HIDE SMILES / InChI

Molecular Formula C22H25NO2
Molecular Weight 335.4394
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:23:17 GMT 2023
Edited
by admin
on Sat Dec 16 01:23:17 GMT 2023
Record UNII
427W7H8YTW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LOBELANINE HYDROBROMIDE
MI  
Common Name English
ETHANONE, 2,2'-(1-METHYL-2,6-PIPERIDINEDIYL)BIS(1-PHENYL-, HYDROBROMIDE, CIS-
Systematic Name English
LOBELANINE HYDROBROMIDE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m281
Created by admin on Sat Dec 16 01:23:17 GMT 2023 , Edited by admin on Sat Dec 16 01:23:17 GMT 2023
PRIMARY Merck Index
CAS
6112-90-9
Created by admin on Sat Dec 16 01:23:17 GMT 2023 , Edited by admin on Sat Dec 16 01:23:17 GMT 2023
PRIMARY
PUBCHEM
90478648
Created by admin on Sat Dec 16 01:23:17 GMT 2023 , Edited by admin on Sat Dec 16 01:23:17 GMT 2023
PRIMARY
FDA UNII
427W7H8YTW
Created by admin on Sat Dec 16 01:23:17 GMT 2023 , Edited by admin on Sat Dec 16 01:23:17 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE