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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H22FNO3
Molecular Weight 391.4348
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Desfluoro Ezetimibe, (3'S,3R,4S)-

SMILES

O[C@@H](CC[C@@H]1[C@H](N(C1=O)C2=CC=C(F)C=C2)C3=CC=C(O)C=C3)C4=CC=CC=C4

InChI

InChIKey=AZKGJGUGALISLD-XPWALMASSA-N
InChI=1S/C24H22FNO3/c25-18-8-10-19(11-9-18)26-23(17-6-12-20(27)13-7-17)21(24(26)29)14-15-22(28)16-4-2-1-3-5-16/h1-13,21-23,27-28H,14-15H2/t21-,22+,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H22FNO3
Molecular Weight 391.4348
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:28:19 GMT 2023
Edited
by admin
on Sat Dec 16 11:28:19 GMT 2023
Record UNII
57H34XFV8F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Desfluoro Ezetimibe, (3'S,3R,4S)-
Common Name English
(3'S,3R,4S)-Desfluoro Ezetimibe
Common Name English
(3R,4S)-1-(4-Fluorophenyl)-4-(4-hydroxyphenyl)-3-[(3S)-3-hydroxy-3-phenylpropyl]-2-azetidinone
Systematic Name English
(3R,4S)-1-(4-Fluorophenyl)-3-[(3S)-3-phenyl-3-hydroxypropyl]-4-(4-hydroxyphenyl)-2-azetidinone
Systematic Name English
2-Azetidinone, 1-(4-fluorophenyl)-4-(4-hydroxyphenyl)-3-[(3S)-3-hydroxy-3-phenylpropyl]-, (3R,4S)-
Systematic Name English
Ezetimibe impurity 1
Common Name English
2-Azetidinone, 1-(4-fluorophenyl)-4-(4-hydroxyphenyl)-3-(3-hydroxy-3-phenylpropyl)-, [3R-[3α(S*),4β]]-
Systematic Name English
Code System Code Type Description
FDA UNII
57H34XFV8F
Created by admin on Sat Dec 16 11:28:19 GMT 2023 , Edited by admin on Sat Dec 16 11:28:19 GMT 2023
PRIMARY
CAS
190595-66-5
Created by admin on Sat Dec 16 11:28:19 GMT 2023 , Edited by admin on Sat Dec 16 11:28:19 GMT 2023
PRIMARY
PUBCHEM
9865244
Created by admin on Sat Dec 16 11:28:19 GMT 2023 , Edited by admin on Sat Dec 16 11:28:19 GMT 2023
PRIMARY