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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H32F2O2
Molecular Weight 354.4744
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3-DIFLUORO-5.ALPHA.-ANDROSTAN-17.BETA.-OL ACETATE

SMILES

[H][C@@]12CC[C@H](OC(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC[C@@]4([H])CC(F)(F)CC[C@]34C

InChI

InChIKey=BUIQHUBDLNDWCY-RBZZARIASA-N
InChI=1S/C21H32F2O2/c1-13(24)25-18-7-6-16-15-5-4-14-12-21(22,23)11-10-19(14,2)17(15)8-9-20(16,18)3/h14-18H,4-12H2,1-3H3/t14-,15-,16-,17-,18-,19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H32F2O2
Molecular Weight 354.4744
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 05:01:31 GMT 2023
Edited
by admin
on Sat Dec 16 05:01:31 GMT 2023
Record UNII
PO853GYS65
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3-DIFLUORO-5.ALPHA.-ANDROSTAN-17.BETA.-OL ACETATE
Systematic Name English
3,3-DIFLUORO-5.ALPHA.-ANDROSTAN-17.BETA.-YL ACETATE
Systematic Name English
5.ALPHA.-ANDROSTAN-17.BETA.-OL, 3,3-DIFLUORO-, ACETATE
Systematic Name English
NSC-53900
Code English
ANDROSTAN-17-OL, 3,3-DIFLUORO-, ACETATE, (5.ALPHA.,17.BETA.)-
Systematic Name English
3,3-DIFLUOROANDROSTANE-17-OL ACETATE
Systematic Name English
Code System Code Type Description
CAS
1827-75-4
Created by admin on Sat Dec 16 05:01:31 GMT 2023 , Edited by admin on Sat Dec 16 05:01:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID001226174
Created by admin on Sat Dec 16 05:01:31 GMT 2023 , Edited by admin on Sat Dec 16 05:01:31 GMT 2023
PRIMARY
PUBCHEM
243754
Created by admin on Sat Dec 16 05:01:31 GMT 2023 , Edited by admin on Sat Dec 16 05:01:31 GMT 2023
PRIMARY
FDA UNII
PO853GYS65
Created by admin on Sat Dec 16 05:01:31 GMT 2023 , Edited by admin on Sat Dec 16 05:01:31 GMT 2023
PRIMARY
NSC
53900
Created by admin on Sat Dec 16 05:01:31 GMT 2023 , Edited by admin on Sat Dec 16 05:01:31 GMT 2023
PRIMARY