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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H21NO2
Molecular Weight 271.3548
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-HYDROXYATOMOXETINE

SMILES

Cc1cc(ccc1O[C@]([H])(CCNC)c2ccccc2)O

InChI

InChIKey=PPXQPRLGNSJNJM-QGZVFWFLSA-N
InChI=1S/C17H21NO2/c1-13-12-15(19)8-9-16(13)20-17(10-11-18-2)14-6-4-3-5-7-14/h3-9,12,17-19H,10-11H2,1-2H3/t17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H21NO2
Molecular Weight 271.3548
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 05:36:16 UTC 2021
Edited
by admin
on Sat Jun 26 05:36:16 UTC 2021
Record UNII
6T2XYC0A9R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-HYDROXYATOMOXETINE
Common Name English
PHENOL, 3-METHYL-4-((1R)-3-(METHYLAMINO)-1-PHENYLPROPOXY)-
Systematic Name English
(-)-PHENOL, 3-METHYL-4-((1R)-3-(METHYLAMINO)-1-PHENYLPROPOXY)-
Systematic Name English
Code System Code Type Description
CAS
435293-66-6
Created by admin on Sat Jun 26 05:36:16 UTC 2021 , Edited by admin on Sat Jun 26 05:36:16 UTC 2021
PRIMARY
PUBCHEM
9816910
Created by admin on Sat Jun 26 05:36:16 UTC 2021 , Edited by admin on Sat Jun 26 05:36:16 UTC 2021
PRIMARY
FDA UNII
6T2XYC0A9R
Created by admin on Sat Jun 26 05:36:16 UTC 2021 , Edited by admin on Sat Jun 26 05:36:16 UTC 2021
PRIMARY
EPA CompTox
435293-66-6
Created by admin on Sat Jun 26 05:36:16 UTC 2021 , Edited by admin on Sat Jun 26 05:36:16 UTC 2021
PRIMARY
Related Record Type Details
BINDER->LIGAND
BINDING
Related Record Type Details
PARENT -> METABOLITE ACTIVE
MAJOR