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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H27FO3
Molecular Weight 346.4357
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6.ALPHA.-FLUORO-PREGN-4-ENE-3,11,20-TRIONE

SMILES

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

InChI

InChIKey=YPUQOVRDUFZIKX-CQMXKPHISA-N
InChI=1S/C21H27FO3/c1-11(23)14-4-5-15-13-9-17(22)16-8-12(24)6-7-20(16,2)19(13)18(25)10-21(14,15)3/h8,13-15,17,19H,4-7,9-10H2,1-3H3/t13-,14+,15-,17-,19+,20-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H27FO3
Molecular Weight 346.4357
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:24:58 GMT 2023
Edited
by admin
on Sat Dec 16 08:24:58 GMT 2023
Record UNII
76WNL6I9N1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6.ALPHA.-FLUORO-PREGN-4-ENE-3,11,20-TRIONE
Systematic Name English
PROGESTERONE,6.ALPHA.-FLUORO-11-OXO-
Common Name English
NSC-59615
Code English
PREGN-4-ENE-3,11,20-TRIONE, 6-FLUORO-, (6.ALPHA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
76WNL6I9N1
Created by admin on Sat Dec 16 08:24:58 GMT 2023 , Edited by admin on Sat Dec 16 08:24:58 GMT 2023
PRIMARY
CAS
433-86-3
Created by admin on Sat Dec 16 08:24:58 GMT 2023 , Edited by admin on Sat Dec 16 08:24:58 GMT 2023
PRIMARY
NSC
59615
Created by admin on Sat Dec 16 08:24:58 GMT 2023 , Edited by admin on Sat Dec 16 08:24:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID90962986
Created by admin on Sat Dec 16 08:24:58 GMT 2023 , Edited by admin on Sat Dec 16 08:24:58 GMT 2023
PRIMARY
PUBCHEM
246487
Created by admin on Sat Dec 16 08:24:58 GMT 2023 , Edited by admin on Sat Dec 16 08:24:58 GMT 2023
PRIMARY