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

Details

Stereochemistry MIXED
Molecular Formula C16H23NO
Molecular Weight 245.3599
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TOLQUINZOLE

SMILES

CCC1(O)CCN2CCC3=C(C=C(C)C=C3)C2C1

InChI

InChIKey=XGCBETZGOIOAKF-UHFFFAOYSA-N
InChI=1S/C16H23NO/c1-3-16(18)7-9-17-8-6-13-5-4-12(2)10-14(13)15(17)11-16/h4-5,10,15,18H,3,6-9,11H2,1-2H3

HIDE SMILES / InChI
Name Type Language
TOLQUINZOLE
INN  
INN  
Official Name English
2-ETHYL-1,3,4,6,7,11B-HEXAHYDRO-10-METHYL-2H-BENZO(A)QUINOLIZIN-2-OL
Common Name English
tolquinzole [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C265
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
Code System Code Type Description
EVMPD
SUB11178MIG
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY
SMS_ID
100000077785
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY
PUBCHEM
3083943
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY
INN
2582
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY
ChEMBL
CHEMBL2105550
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY
NCI_THESAURUS
C152689
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY
CAS
6187-50-4
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY
EPA CompTox
DTXSID70863705
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY
FDA UNII
Z6I7X5PELK
Created by admin on Fri Dec 15 16:50:37 GMT 2023 , Edited by admin on Fri Dec 15 16:50:37 GMT 2023
PRIMARY