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Details

Stereochemistry ACHIRAL
Molecular Formula C19H16I2O3
Molecular Weight 546.1375
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-1086

SMILES

CCCCC1=C(C(=O)C2=CC(I)=C(O)C(I)=C2)C3=C(O1)C=CC=C3

InChI

InChIKey=PNFMEGSMKIHDFZ-UHFFFAOYSA-N
InChI=1S/C19H16I2O3/c1-2-3-7-16-17(12-6-4-5-8-15(12)24-16)18(22)11-9-13(20)19(23)14(21)10-11/h4-6,8-10,23H,2-3,7H2,1H3

HIDE SMILES / InChI

Molecular Formula C19H16I2O3
Molecular Weight 546.1375
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 Thu Jul 06 13:05:01 UTC 2023
Edited
by admin
on Thu Jul 06 13:05:01 UTC 2023
Record UNII
D8YC83C05N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
S-1086
Common Name English
KETONE, 2-BUTYL-3-BENZOFURANYL 4-HYDROXY-3,5-DIIODOPHENYL
Systematic Name English
NSC-85437
Code English
(2-BUTYLBENZOFURAN-3-YL)(4-HYDROXY-3,5-DIIODOPHENYL)METHANONE
Systematic Name English
AMIODARONE METABOLITE M3
Common Name English
L 3373
Code English
AMIODARONE RELATED COMPOUND B
Common Name English
L-3373
Common Name English
O-DEALKYLATED METABOLITE OF AMIODARONE
Common Name English
METHANONE, (2-BUTYL-3-BENZOFURANYL)(4-HYDROXY-3,5-DIIODOPHENYL)-
Systematic Name English
S 1086
Code English
AMIODARONE HYDROCHLORIDE IMPURITY D [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
74769
Created by admin on Thu Jul 06 13:05:01 UTC 2023 , Edited by admin on Thu Jul 06 13:05:01 UTC 2023
PRIMARY
EPA CompTox
DTXSID20173164
Created by admin on Thu Jul 06 13:05:01 UTC 2023 , Edited by admin on Thu Jul 06 13:05:01 UTC 2023
PRIMARY
CAS
1951-26-4
Created by admin on Thu Jul 06 13:05:01 UTC 2023 , Edited by admin on Thu Jul 06 13:05:01 UTC 2023
PRIMARY
ECHA (EC/EINECS)
217-773-7
Created by admin on Thu Jul 06 13:05:01 UTC 2023 , Edited by admin on Thu Jul 06 13:05:01 UTC 2023
PRIMARY
NSC
85437
Created by admin on Thu Jul 06 13:05:01 UTC 2023 , Edited by admin on Thu Jul 06 13:05:01 UTC 2023
PRIMARY
FDA UNII
D8YC83C05N
Created by admin on Thu Jul 06 13:05:01 UTC 2023 , Edited by admin on Thu Jul 06 13:05:01 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
BILE
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP