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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H12N2
Molecular Weight 160.2157
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ANATABINE

SMILES

C1N[C@@H](CC=C1)C2=CN=CC=C2

InChI

InChIKey=SOPPBXUYQGUQHE-JTQLQIEISA-N
InChI=1S/C10H12N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h1-4,6,8,10,12H,5,7H2/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H12N2
Molecular Weight 160.2157
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

PubMed

PubMed

TitleDatePubMed
Gas chromatographic-mass spectrometric method for determination of anabasine, anatabine and other tobacco alkaloids in urine of smokers and smokeless tobacco users.
1993 Sep 8
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:50:50 GMT 2025
Edited
by admin
on Mon Mar 31 19:50:50 GMT 2025
Record UNII
5PP654XB7D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ANATABINE
MI   WHO-DD  
Common Name English
(-)-ANATABINE
Preferred Name English
NICOTINE RESINATE IMPURITY A [EP IMPURITY]
Common Name English
NICOTINE DITARTRATE DIHYDRATE IMPURITY A [EP IMPURITY]
Common Name English
ANATABINE, (-)-
Common Name English
(S)-(-)-ANATABINE
Common Name English
(S)-ANATABINE
Common Name English
NICOTINE IMPURITY A [EP IMPURITY]
Common Name English
Anatabine [WHO-DD]
Common Name English
2,3'-BIPYRIDINE, 1,2,3,6-TETRAHYDRO-, (2S)-
Systematic Name English
NICOTINE RELATED COMPOUND A [USP IMPURITY]
Common Name English
ANATABINE [MI]
Common Name English
(2S)-1,2,3,6-TETRAHYDRO-2,3'-BIPYRIDINE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C221
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
DSLD 213 (Number of products:11)
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
Code System Code Type Description
SMS_ID
100000182814
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY
EVMPD
SUB197096
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID901016110
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY
PUBCHEM
11388
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY
FDA UNII
5PP654XB7D
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY
WIKIPEDIA
ANATABINE
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY
MERCK INDEX
m1890
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY Merck Index
MESH
C012737
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY
NCI_THESAURUS
C114277
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY NCIT
CAS
581-49-7
Created by admin on Mon Mar 31 19:50:50 GMT 2025 , Edited by admin on Mon Mar 31 19:50:50 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
PARENT -> CONSTITUENT ALWAYS PRESENT
ANATABINE (ug/cigarette) Canadian = 477.1 SD(64.1) Imported = 398.0 SD(93.4)
Related Record Type Details
PARENT -> IMPURITY
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
PARENT -> IMPURITY