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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H21ClN2
Molecular Weight 300.826
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESMETHYLCLOMIPRAMINE

SMILES

CNCCCN1C2=CC=CC=C2CCC3=C1C=C(Cl)C=C3

InChI

InChIKey=VPIXQGUBUKFLRF-UHFFFAOYSA-N
InChI=1S/C18H21ClN2/c1-20-11-4-12-21-17-6-3-2-5-14(17)7-8-15-9-10-16(19)13-18(15)21/h2-3,5-6,9-10,13,20H,4,7-8,11-12H2,1H3

HIDE SMILES / InChI

Molecular Formula C18H21ClN2
Molecular Weight 300.826
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 Fri Dec 15 19:12:08 UTC 2023
Edited
by admin
on Fri Dec 15 19:12:08 UTC 2023
Record UNII
01DN47PPQG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESMETHYLCLOMIPRAMINE
WHO-DD  
Common Name English
NORCHLORIMIPRAMINE
Common Name English
5H-DIBENZ(B,F)AZEPINE-5-PROPANAMINE, 3-CHLORO-10,11-DIHYDRO-N-METHYL-
Systematic Name English
GP-38025
Code English
Desmethylclomipramine [WHO-DD]
Common Name English
Code System Code Type Description
CAS
303-48-0
Created by admin on Fri Dec 15 19:12:08 UTC 2023 , Edited by admin on Fri Dec 15 19:12:08 UTC 2023
PRIMARY
SMS_ID
100000181521
Created by admin on Fri Dec 15 19:12:08 UTC 2023 , Edited by admin on Fri Dec 15 19:12:08 UTC 2023
PRIMARY
FDA UNII
01DN47PPQG
Created by admin on Fri Dec 15 19:12:08 UTC 2023 , Edited by admin on Fri Dec 15 19:12:08 UTC 2023
PRIMARY
EVMPD
SUB195252
Created by admin on Fri Dec 15 19:12:08 UTC 2023 , Edited by admin on Fri Dec 15 19:12:08 UTC 2023
PRIMARY
PUBCHEM
622606
Created by admin on Fri Dec 15 19:12:08 UTC 2023 , Edited by admin on Fri Dec 15 19:12:08 UTC 2023
PRIMARY
EPA CompTox
DTXSID70952663
Created by admin on Fri Dec 15 19:12:08 UTC 2023 , Edited by admin on Fri Dec 15 19:12:08 UTC 2023
PRIMARY
WIKIPEDIA
Norclomipramine
Created by admin on Fri Dec 15 19:12:08 UTC 2023 , Edited by admin on Fri Dec 15 19:12:08 UTC 2023
PRIMARY
Related Record Type Details
METABOLIC ENZYME -> INHIBITOR
IC50
Related Record Type Details
PARENT -> METABOLITE ACTIVE
MAJOR