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

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H34ClN3S2
Molecular Weight 428.098
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TROPANTIOL

SMILES

CN1[C@H]2CC[C@@H]1[C@@H](CN(CCS)CCNCCS)[C@H](C2)C3=CC=C(Cl)C=C3

InChI

InChIKey=HZLFSOZSLFKJKA-JSXRDJHFSA-N
InChI=1S/C21H34ClN3S2/c1-24-18-6-7-21(24)20(15-25(11-13-27)10-8-23-9-12-26)19(14-18)16-2-4-17(22)5-3-16/h2-5,18-21,23,26-27H,6-15H2,1H3/t18-,19+,20-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H34ClN3S2
Molecular Weight 428.098
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Tropantiol is a chelating agent. It was used in diagnosis or exclusion of Parkinsonian syndrome with or without dopaminergic deficit.

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:04:31 GMT 2023
Edited
by admin
on Fri Dec 15 16:04:31 GMT 2023
Record UNII
7844H41L5Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TROPANTIOL
INN   USAN  
INN   USAN  
Official Name English
tropantiol [INN]
Common Name English
NC100697
Code English
TROPANTIOL [USAN]
Common Name English
NC-100697
Code English
Classification Tree Code System Code
NCI_THESAURUS C360
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
Code System Code Type Description
ChEMBL
CHEMBL2104990
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
NCI_THESAURUS
C76601
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID50940523
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
FDA UNII
7844H41L5Z
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
SMS_ID
300000034407
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
INN
8884
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
USAN
SS-82
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
CAS
189950-11-6
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
PUBCHEM
10670183
Created by admin on Fri Dec 15 16:04:31 GMT 2023 , Edited by admin on Fri Dec 15 16:04:31 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
LABELED -> NON-LABELED
Related Record Type Details
ACTIVE MOIETY