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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H37FO6
Molecular Weight 476.5775
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PARAMETHASONE TRIMETHYLACETATE

SMILES

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

InChI

InChIKey=BHXGVYISZWSEJE-ROLYQIAQSA-N
InChI=1S/C27H37FO6/c1-14-9-17-16-11-19(28)18-10-15(29)7-8-25(18,5)22(16)20(30)12-26(17,6)27(14,33)21(31)13-34-23(32)24(2,3)4/h7-8,10,14,16-17,19-20,22,30,33H,9,11-13H2,1-6H3/t14-,16+,17+,19+,20+,22-,25+,26+,27+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
PARAMETHASONE TRIMETHYLACETATE
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 6.ALPHA.-FLUORO-11.BETA.,17,21-TRIHYDROXY-16.ALPHA.-METHYL-, 21-PIVALATE
Systematic Name English
PREGNA-1,4-DIENE-3,20-DIONE, 21-(2,2-DIMETHYL-1-OXOPROPOXY)-6-FLUORO-11,17-DIHYDROXY-16-METHYL-, (6.ALPHA.,11.BETA.,16.ALPHA.)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
217-658-1
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY
CAS
1926-93-8
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID50940922
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY
FDA UNII
0H1NO20432
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY
PUBCHEM
21117760
Created by admin on Sat Dec 16 08:46:49 GMT 2023 , Edited by admin on Sat Dec 16 08:46:49 GMT 2023
PRIMARY