U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C33H43FO7
Molecular Weight 570.6887
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEXAMETHASONE CIPECILATE

SMILES

[H][C@@]12C[C@@H](C)[C@](OC(=O)C3CC3)(C(=O)COC(=O)C4CCCCC4)[C@@]1(C)C[C@H](O)[C@@]5(F)[C@@]2([H])CCC6=CC(=O)C=C[C@]56C

InChI

InChIKey=JPTKVJWWVFLEJL-GVPGRCOTSA-N
InChI=1S/C33H43FO7/c1-19-15-25-24-12-11-22-16-23(35)13-14-30(22,2)32(24,34)26(36)17-31(25,3)33(19,41-29(39)21-9-10-21)27(37)18-40-28(38)20-7-5-4-6-8-20/h13-14,16,19-21,24-26,36H,4-12,15,17-18H2,1-3H3/t19-,24+,25+,26+,30+,31+,32+,33+/m1/s1

HIDE SMILES / InChI

Molecular Formula C33H43FO7
Molecular Weight 570.6887
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:06:53 UTC 2023
Edited
by admin
on Fri Dec 15 16:06:53 UTC 2023
Record UNII
T51D685OXG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEXAMETHASONE CIPECILATE
INN   JAN   WHO-DD  
INN  
Official Name English
DEXAMETHASONE CIPECILATE [JAN]
Common Name English
Dexamethasone Cipecilate [WHO-DD]
Common Name English
dexamethasone cipecilate [INN]
Common Name English
9-FLUORO-11.BETA.-HYDROXY-16.ALPHA.-METHYL-3,20-DIOXOPREGNA-1,4-DIENE-17,21-DIYL 21-CYCLOHEXANECARBOXYLATE 17-CYCLOPROPANECARBOXYLATE
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C521
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
Code System Code Type Description
CAS
132245-57-9
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
PRIMARY
FDA UNII
T51D685OXG
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
PRIMARY
EVMPD
SUB35396
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
PRIMARY
NCI_THESAURUS
C77416
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
PRIMARY
SMS_ID
100000128389
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
PRIMARY
INN
8632
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
PRIMARY
EPA CompTox
DTXSID50927596
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
PRIMARY
PUBCHEM
15159004
Created by admin on Fri Dec 15 16:06:54 UTC 2023 , Edited by admin on Fri Dec 15 16:06:54 UTC 2023
PRIMARY
Related Record Type Details
METABOLITE ACTIVE -> PRODRUG
Related Record Type Details
ACTIVE MOIETY