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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H30ClFO5
Molecular Weight 452.943
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLOCORTOLONE ACETATE

SMILES

[H][C@@]12C[C@@H](C)[C@H](C(=O)COC(C)=O)[C@@]1(C)C[C@H](O)[C@@]3(Cl)[C@@]2([H])C[C@H](F)C4=CC(=O)C=C[C@]34C

InChI

InChIKey=ARPLCFGLEYFDCN-CDACMRRYSA-N
InChI=1S/C24H30ClFO5/c1-12-7-15-16-9-18(26)17-8-14(28)5-6-23(17,4)24(16,25)20(30)10-22(15,3)21(12)19(29)11-31-13(2)27/h5-6,8,12,15-16,18,20-21,30H,7,9-11H2,1-4H3/t12-,15+,16+,18+,20+,21-,22+,23+,24+/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H30ClFO5
Molecular Weight 452.943
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:21:03 UTC 2023
Edited
by admin
on Fri Dec 15 16:21:03 UTC 2023
Record UNII
85061HTR8T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CLOCORTOLONE ACETATE
USAN  
USAN  
Official Name English
9-Chloro-6α-fluoro-11β,21-dihydroxy-16α-methylpregna-1,4-diene-3,20-dione 21-acetate
Systematic Name English
CLOCORTOLONE ACETATE [USAN]
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 21-(ACETYLOXY)-9-CHLORO-6-FLUORO-11-HYDROXY-16-METHYL-, (6.ALPHA.,11.BETA.,16.ALPHA.)-
Systematic Name English
SH 818
Code English
CLOCORTOLONE 21-ACETATE [MI]
Common Name English
CLOCORTOLONE 21-ACETATE
MI  
Common Name English
SH-818
Code English
Classification Tree Code System Code
NCI_THESAURUS C521
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID00962578
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY
DRUG BANK
DB14652
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY
CAS
4258-85-9
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY
PUBCHEM
11954353
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY
ChEMBL
CHEMBL2106011
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY
NCI_THESAURUS
C77410
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY
FDA UNII
85061HTR8T
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY
MERCK INDEX
m3633
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY Merck Index
MESH
C004686
Created by admin on Fri Dec 15 16:21:03 UTC 2023 , Edited by admin on Fri Dec 15 16:21:03 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY