U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C22H25NO2
Molecular Weight 335.4394
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LOBELANINE

SMILES

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

InChI

InChIKey=IDEMKXUAULKYJV-BGYRXZFFSA-N
InChI=1S/C22H25NO2/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/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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:13:18 GMT 2023
Edited
by admin
on Sat Dec 16 09:13:18 GMT 2023
Record UNII
4XWB84090T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LOBELANINE
MI  
Common Name English
MESO-LOBELANINE
Common Name English
8,10-DIPHENYLLOBELIDIONE
Common Name English
ETHANONE, 2,2'-(1-METHYL-2,6-PIPERIDINEDIYL)BIS(1-PHENYL-, CIS-
Common Name English
LOBELANINE [MI]
Common Name English
ETHANONE, 2,2'-(1-METHYL-2,6-PIPERIDINEDIYL)BIS(1-PHENYL-, (2R,6S)-REL-
Systematic Name English
Code System Code Type Description
PUBCHEM
442647
Created by admin on Sat Dec 16 09:13:18 GMT 2023 , Edited by admin on Sat Dec 16 09:13:18 GMT 2023
PRIMARY
CAS
579-21-5
Created by admin on Sat Dec 16 09:13:18 GMT 2023 , Edited by admin on Sat Dec 16 09:13:18 GMT 2023
PRIMARY
CAS
324078-50-4
Created by admin on Sat Dec 16 09:13:18 GMT 2023 , Edited by admin on Sat Dec 16 09:13:18 GMT 2023
ALTERNATIVE
WIKIPEDIA
Lobelanine
Created by admin on Sat Dec 16 09:13:18 GMT 2023 , Edited by admin on Sat Dec 16 09:13:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID10206617
Created by admin on Sat Dec 16 09:13:18 GMT 2023 , Edited by admin on Sat Dec 16 09:13:18 GMT 2023
PRIMARY
MERCK INDEX
m281
Created by admin on Sat Dec 16 09:13:18 GMT 2023 , Edited by admin on Sat Dec 16 09:13:18 GMT 2023
PRIMARY Merck Index
FDA UNII
4XWB84090T
Created by admin on Sat Dec 16 09:13:18 GMT 2023 , Edited by admin on Sat Dec 16 09:13:18 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT