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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H31FO
Molecular Weight 294.4472
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3.BETA.-FLUORO-5.ALPHA.-ANDROSTAN-17.BETA.-OL

SMILES

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

InChI

InChIKey=DKYZAPZHDVDDSJ-YSZCXEEOSA-N
InChI=1S/C19H31FO/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-17,21H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,17-,18-,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H31FO
Molecular Weight 294.4472
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:09:59 GMT 2023
Edited
by admin
on Fri Dec 15 15:09:59 GMT 2023
Record UNII
N0K1CDK91R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3.BETA.-FLUORO-5.ALPHA.-ANDROSTAN-17.BETA.-OL
Systematic Name English
ANDROSTAN-17-OL, 3-FLUORO-, (3.BETA.,5.ALPHA.,17.BETA.)-
Systematic Name English
NSC-61689
Code English
5.ALPHA.-ANDROSTAN-17.BETA.-OL, 3.BETA.-FLUORO-
Systematic Name English
Code System Code Type Description
PUBCHEM
247285
Created by admin on Fri Dec 15 15:09:59 GMT 2023 , Edited by admin on Fri Dec 15 15:09:59 GMT 2023
PRIMARY
CAS
438-19-7
Created by admin on Fri Dec 15 15:09:59 GMT 2023 , Edited by admin on Fri Dec 15 15:09:59 GMT 2023
PRIMARY
FDA UNII
N0K1CDK91R
Created by admin on Fri Dec 15 15:09:59 GMT 2023 , Edited by admin on Fri Dec 15 15:09:59 GMT 2023
PRIMARY
NSC
61689
Created by admin on Fri Dec 15 15:09:59 GMT 2023 , Edited by admin on Fri Dec 15 15:09:59 GMT 2023
PRIMARY