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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H32F2O5
Molecular Weight 437.5072
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-FLUORO-(21-FLUORO F-18)-11.BETA.,16.ALPHA.,17-TRIHYDROXYPREGN-4-ENE-3,20-DIONE-16,17-ACETONIDE

SMILES

[H][C@@]12C[C@H]3OC(C)(C)O[C@@]3(C(=O)C[18F])[C@@]1(C)C[C@H](O)[C@@]4(F)[C@@]2([H])CCC5=CC(=O)CC[C@]45C

InChI

InChIKey=ITHJZTMTGUYYGI-XPZMJKKXSA-N
InChI=1S/C24H32F2O5/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,26)17(28)11-22(16,4)24(19,31-20)18(29)12-25/h9,15-17,19,28H,5-8,10-12H2,1-4H3/t15-,16-,17-,19+,21-,22-,23-,24+/m0/s1/i25-1

HIDE SMILES / InChI

Approval Year

Name Type Language
9-FLUORO-(21-FLUORO F-18)-11.BETA.,16.ALPHA.,17-TRIHYDROXYPREGN-4-ENE-3,20-DIONE-16,17-ACETONIDE
Common Name English
Code System Code Type Description
PUBCHEM
119025896
Created by admin on Sat Dec 16 10:40:47 GMT 2023 , Edited by admin on Sat Dec 16 10:40:47 GMT 2023
PRIMARY
FDA UNII
A4J26265CU
Created by admin on Sat Dec 16 10:40:47 GMT 2023 , Edited by admin on Sat Dec 16 10:40:47 GMT 2023
PRIMARY
CAS
1036915-23-7
Created by admin on Sat Dec 16 10:40:47 GMT 2023 , Edited by admin on Sat Dec 16 10:40:47 GMT 2023
PRIMARY