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Details

Stereochemistry ACHIRAL
Molecular Formula C22H21FO2
Molecular Weight 336.3993
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of K-80003

SMILES

CC(C)C1=CC=C(\C=C2\C(C)=C(CC(O)=O)C3=C2C=CC(F)=C3)C=C1

InChI

InChIKey=QCXBVGNDRYQVJO-GRSHGNNSSA-N
InChI=1S/C22H21FO2/c1-13(2)16-6-4-15(5-7-16)10-19-14(3)20(12-22(24)25)21-11-17(23)8-9-18(19)21/h4-11,13H,12H2,1-3H3,(H,24,25)/b19-10-

HIDE SMILES / InChI

Molecular Formula C22H21FO2
Molecular Weight 336.3993
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 18:58:44 UTC 2023
Edited
by admin
on Thu Jul 06 18:58:44 UTC 2023
Record UNII
4S7931G4PP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
K-80003
Common Name English
TX-803
Common Name English
1H-INDENE-3-ACETIC ACID, 5-FLUORO-2-METHYL-1-((4-(1-METHYLETHYL)PHENYL)METHYLENE)-, (1Z)-
Systematic Name English
Code System Code Type Description
FDA UNII
4S7931G4PP
Created by admin on Thu Jul 06 18:58:44 UTC 2023 , Edited by admin on Thu Jul 06 18:58:44 UTC 2023
PRIMARY
CHEBI
59660
Created by admin on Thu Jul 06 18:58:44 UTC 2023 , Edited by admin on Thu Jul 06 18:58:44 UTC 2023
PRIMARY
PUBCHEM
46224594
Created by admin on Thu Jul 06 18:58:44 UTC 2023 , Edited by admin on Thu Jul 06 18:58:44 UTC 2023
PRIMARY
CAS
1292821-90-9
Created by admin on Thu Jul 06 18:58:44 UTC 2023 , Edited by admin on Thu Jul 06 18:58:44 UTC 2023
PRIMARY
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