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Details

Stereochemistry RACEMIC
Molecular Formula C20H21N
Molecular Weight 275.3874
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0
Stereo Comments Assumed racemic

SHOW SMILES / InChI
Structure of OCTRIPTYLINE

SMILES

[H][C@]12C[C@@]1([H])C3=C(C=CC=C3)\C(=C/CCNC)C4=CC=CC=C24

InChI

InChIKey=MILRTYCRJIRPKY-IKXRLOQMSA-N
InChI=1S/C20H21N/c1-21-12-6-11-16-14-7-2-4-9-17(14)19-13-20(19)18-10-5-3-8-15(16)18/h2-5,7-11,19-21H,6,12-13H2,1H3/b16-11-/t19-,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H21N
Molecular Weight 275.3874
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:58:30 UTC 2023
Edited
by admin
on Fri Dec 15 15:58:30 UTC 2023
Record UNII
C3X0UOC25D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OCTRIPTYLINE
INN  
INN  
Official Name English
octriptyline [INN]
Common Name English
Code System Code Type Description
NCI_THESAURUS
C174650
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
INN
3728
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
FDA UNII
C3X0UOC25D
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110951
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
EPA CompTox
DTXSID10963758
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
CAS
47166-67-6
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
SMS_ID
100000083289
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
WIKIPEDIA
Octriptyline
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
EVMPD
SUB09418MIG
Created by admin on Fri Dec 15 15:58:30 UTC 2023 , Edited by admin on Fri Dec 15 15:58:30 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY