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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H30F2N4O3
Molecular Weight 460.5168
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of KAG-308

SMILES

C[C@@H]([C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H]2O\C(=C/CCCC3=NN=NN3)C(F)(F)[C@H]12)C4=CC=CC(C)=C4

InChI

InChIKey=KSELABKNBIUMGG-YGBAREPYSA-N
InChI=1S/C24H30F2N4O3/c1-14-6-5-7-16(12-14)15(2)18(31)11-10-17-19(32)13-20-23(17)24(25,26)21(33-20)8-3-4-9-22-27-29-30-28-22/h5-8,10-12,15,17-20,23,31-32H,3-4,9,13H2,1-2H3,(H,27,28,29,30)/b11-10+,21-8-/t15-,17+,18-,19-,20+,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H30F2N4O3
Molecular Weight 460.5168
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:05:48 GMT 2025
Edited
by admin
on Wed Apr 02 17:05:48 GMT 2025
Record UNII
33CGC8N6S3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
KAG-308
Common Name English
(2Z,3aR,4R,5R,6aS)-3,3-Difluorohexahydro-4-[(1E,3R,4R)-3-hydroxy-4-(3-methylphenyl)-1-penten-1-yl]-2-[4-(2H-tetrazol-5-yl)butylidene]-2H-cyclopenta[b]furan-5-ol
Preferred Name English
2H-Cyclopenta[b]furan-5-ol, 3,3-difluorohexahydro-4-[(1E,3R,4R)-3-hydroxy-4-(3-methylphenyl)-1-penten-1-yl]-2-[4-(2H-tetrazol-5-yl)butylidene]-, (2Z,3aR,4R,5R,6aS)-
Systematic Name English
4-[(Z)-(1S,5R,6R,7R)-6-[(1E,3R,4R)-3-Hydroxy-4-(m-tolyl)-1-pentenyl]-7-hydroxy-4,4-difluoro-2-oxabicyclo[3.3.0]octan-3-ylidene]-1-(tetrazol-5-yl)butane
Systematic Name English
Code System Code Type Description
CAS
1215192-68-9
Created by admin on Wed Apr 02 17:05:48 GMT 2025 , Edited by admin on Wed Apr 02 17:05:48 GMT 2025
PRIMARY
PUBCHEM
67108613
Created by admin on Wed Apr 02 17:05:48 GMT 2025 , Edited by admin on Wed Apr 02 17:05:48 GMT 2025
PRIMARY
FDA UNII
33CGC8N6S3
Created by admin on Wed Apr 02 17:05:48 GMT 2025 , Edited by admin on Wed Apr 02 17:05:48 GMT 2025
PRIMARY
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