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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H38ClFO5
Molecular Weight 509.05
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CLOCORTOLONE CAPROATE

SMILES

[H][C@@]12C[C@@H](C)[C@H](C(=O)COC(=O)CCCCC)[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=MMTRTBFDFNRBQO-ANHDKODLSA-N
InChI=1S/C28H38ClFO5/c1-5-6-7-8-24(34)35-15-22(32)25-16(2)11-18-19-13-21(30)20-12-17(31)9-10-27(20,4)28(19,29)23(33)14-26(18,25)3/h9-10,12,16,18-19,21,23,25,33H,5-8,11,13-15H2,1-4H3/t16-,18+,19+,21+,23+,25-,26+,27+,28+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CLOCORTOLONE CAPROATE
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 9-CHLORO-6-FLUORO-11-HYDROXY-16-METHYL-21-((1-OXOHEXYL)OXY)-, (6.ALPHA.,11.BETA.,16.ALPHA.)-
Common Name English
CLOCORTOLONE HEXANOATE
WHO-DD  
Common Name English
Clocortolone hexanoate [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C521
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
Code System Code Type Description
FDA UNII
871M9PSU7T
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY
ECHA (EC/EINECS)
225-513-9
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY
EPA CompTox
DTXSID30964141
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY
NCI_THESAURUS
C98251
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY
SMS_ID
100000090230
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY
DRUG BANK
DB14653
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY
CAS
4891-71-8
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY
EVMPD
SUB01351MIG
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY
PUBCHEM
107603
Created by admin on Fri Dec 15 16:53:19 UTC 2023 , Edited by admin on Fri Dec 15 16:53:19 UTC 2023
PRIMARY