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

Details

Stereochemistry RACEMIC
Molecular Formula C23H24N2O4
Molecular Weight 392.4477
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-DESMETHYLCARVEDILOL

SMILES

OC(CNCCOC1=C(O)C=CC=C1)COC2=CC=CC3=C2C4=C(N3)C=CC=C4

InChI

InChIKey=XAUKPPPYYOKVQJ-UHFFFAOYSA-N
InChI=1S/C23H24N2O4/c26-16(14-24-12-13-28-21-10-4-3-9-20(21)27)15-29-22-11-5-8-19-23(22)17-6-1-2-7-18(17)25-19/h1-11,16,24-27H,12-15H2

HIDE SMILES / InChI

Molecular Formula C23H24N2O4
Molecular Weight 392.4477
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:45:08 UTC 2023
Edited
by admin
on Sat Dec 16 09:45:08 UTC 2023
Record UNII
W0HIU4LI95
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-DESMETHYLCARVEDILOL
Common Name English
BM-14242
Code English
PHENOL, 2-(2-((3-(9H-CARBAZOL-4-YLOXY)-2-HYDROXYPROPYL)AMINO)ETHOXY)-
Systematic Name English
DESMETHYLCARVEDILOL
Common Name English
DESMETHYLCARVEDILOL, (±)-
Common Name English
Code System Code Type Description
PUBCHEM
155763
Created by admin on Sat Dec 16 09:45:08 UTC 2023 , Edited by admin on Sat Dec 16 09:45:08 UTC 2023
PRIMARY
CAS
72956-44-6
Created by admin on Sat Dec 16 09:45:08 UTC 2023 , Edited by admin on Sat Dec 16 09:45:08 UTC 2023
PRIMARY
EPA CompTox
DTXSID60993727
Created by admin on Sat Dec 16 09:45:08 UTC 2023 , Edited by admin on Sat Dec 16 09:45:08 UTC 2023
PRIMARY
FDA UNII
W0HIU4LI95
Created by admin on Sat Dec 16 09:45:08 UTC 2023 , Edited by admin on Sat Dec 16 09:45:08 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE