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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H33FO5
Molecular Weight 420.5142
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 12.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17-TRIHYDROXYPREGN-4-ENE-3,20-DIONE 16,17-ACETONIDE

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])CCC5=CC(=O)CC[C@]5(C)[C@@]4([H])[C@@H](O)[C@H](F)[C@]3(C)[C@@]1(OC(C)(C)O2)C(C)=O

InChI

InChIKey=KFEFMDVGRISQNP-AFCBUPGXSA-N
InChI=1S/C24H33FO5/c1-12(26)24-17(29-21(2,3)30-24)11-16-15-7-6-13-10-14(27)8-9-22(13,4)18(15)19(28)20(25)23(16,24)5/h10,15-20,28H,6-9,11H2,1-5H3/t15-,16-,17+,18+,19+,20-,22-,23+,24+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
12.ALPHA.-FLUORO-11.BETA.,16.ALPHA.,17-TRIHYDROXYPREGN-4-ENE-3,20-DIONE 16,17-ACETONIDE
Systematic Name English
PREGN-4-ENE-3,20-DIONE, 12-FLUORO-11-HYDROXY-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (11.BETA.,12.ALPHA.,16.ALPHA.)-
Systematic Name English
Code System Code Type Description
CAS
3937-90-4
Created by admin on Fri Dec 15 15:08:35 GMT 2023 , Edited by admin on Fri Dec 15 15:08:35 GMT 2023
PRIMARY
PUBCHEM
156028134
Created by admin on Fri Dec 15 15:08:35 GMT 2023 , Edited by admin on Fri Dec 15 15:08:35 GMT 2023
PRIMARY
FDA UNII
6EO9UZ9I67
Created by admin on Fri Dec 15 15:08:35 GMT 2023 , Edited by admin on Fri Dec 15 15:08:35 GMT 2023
PRIMARY