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Details

Stereochemistry ACHIRAL
Molecular Formula C20H25NO
Molecular Weight 295.4186
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMITRIPTYNOL

SMILES

CN(C)CCCC1(O)C2=C(CCC3=C1C=CC=C3)C=CC=C2

InChI

InChIKey=ONSQUXZPOPTSQF-UHFFFAOYSA-N
InChI=1S/C20H25NO/c1-21(2)15-7-14-20(22)18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)20/h3-6,8-11,22H,7,12-15H2,1-2H3

HIDE SMILES / InChI
Molecular Formula C20H25NO
Molecular Weight 295.4186
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
139594
Substance Class Chemical
Created
by admin
on Sat Dec 16 05:55:11 UTC 2023
Edited
by admin
on Sat Dec 16 05:55:11 UTC 2023
Record UNII
67H6DX3NOO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMITRIPTYNOL
Common Name English
AMITRIPTYLINE RELATED COMPOUND B [USP-RS]
Common Name English
NORTRIPTYLINE HYDROCHLORIDE IMPURITY D [EP IMPURITY]
Common Name English
5H-DIBENZO(A,D)CYCLOHEPTEN-5-OL, 5-(3-(DIMETHYLAMINO)PROPYL)-10,11-DIHYDRO-
Systematic Name English
AMITRIPTYLINE RELATED COMPOUND B
USP-RS  
Common Name English
5-(3-(DIMETHYLAMINO)PROPYL)-10,11-DIHYDRO-5H-DIBENZO(A,D)-CYCLOHEPTEN-5-OL
Systematic Name English
AMITRIPTYLINE HYDROCHLORIDE IMPURITY D [EP IMPURITY]
Common Name English
5-(3-(DIMETHYLAMINO)PROPYL)-10,11-DIHYDRO-5H-DIBENZO(A,D)(7)ANNULEN-5-OL
Common Name English
Code System Code Type Description
CAS
1159-03-1
Created by admin on Sat Dec 16 05:55:12 UTC 2023 , Edited by admin on Sat Dec 16 05:55:12 UTC 2023
PRIMARY
ECHA (EC/EINECS)
214-594-6
Created by admin on Sat Dec 16 05:55:12 UTC 2023 , Edited by admin on Sat Dec 16 05:55:12 UTC 2023
PRIMARY
PUBCHEM
14390
Created by admin on Sat Dec 16 05:55:12 UTC 2023 , Edited by admin on Sat Dec 16 05:55:12 UTC 2023
PRIMARY
RS_ITEM_NUM
1029024
Created by admin on Sat Dec 16 05:55:12 UTC 2023 , Edited by admin on Sat Dec 16 05:55:12 UTC 2023
PRIMARY
FDA UNII
67H6DX3NOO
Created by admin on Sat Dec 16 05:55:12 UTC 2023 , Edited by admin on Sat Dec 16 05:55:12 UTC 2023
PRIMARY
EPA CompTox
DTXSID10151214
Created by admin on Sat Dec 16 05:55:12 UTC 2023 , Edited by admin on Sat Dec 16 05:55:12 UTC 2023
PRIMARY
Related Record Type Details
Structure of AMITRIPTYNOL HYDROCHLORIDE
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of NORTRIPTYLINE HYDROCHLORIDE
PARENT -> IMPURITY
For the calculation of contents, multiply the peak areas by 1.7
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of AMITRIPTYLINE HYDROCHLORIDE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
NIH
NCATS
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