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

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H24O3
Molecular Weight 300.3921
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 19-ALDOANDROSTENEDIONE

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C=O)[C@@H]1CCC2=O

InChI

InChIKey=XRCFMDPVHKVRDJ-BGJMDTOESA-N
InChI=1S/C19H24O3/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h10-11,14-16H,2-9H2,1H3/t14-,15-,16-,18-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H24O3
Molecular Weight 300.3921
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 17:53:48 GMT 2025
Edited
by admin
on Mon Mar 31 17:53:48 GMT 2025
Record UNII
X07F7694NW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-76985
Preferred Name English
19-ALDOANDROSTENEDIONE
Common Name English
ANDROSTENEDIONE, 19-ALDEHYDE
Common Name English
Code System Code Type Description
FDA UNII
X07F7694NW
Created by admin on Mon Mar 31 17:53:48 GMT 2025 , Edited by admin on Mon Mar 31 17:53:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID00242509
Created by admin on Mon Mar 31 17:53:48 GMT 2025 , Edited by admin on Mon Mar 31 17:53:48 GMT 2025
PRIMARY
NSC
76985
Created by admin on Mon Mar 31 17:53:48 GMT 2025 , Edited by admin on Mon Mar 31 17:53:48 GMT 2025
PRIMARY
PUBCHEM
92854
Created by admin on Mon Mar 31 17:53:48 GMT 2025 , Edited by admin on Mon Mar 31 17:53:48 GMT 2025
PRIMARY
CAS
968-49-0
Created by admin on Mon Mar 31 17:53:48 GMT 2025 , Edited by admin on Mon Mar 31 17:53:48 GMT 2025
PRIMARY
CHEBI
799
Created by admin on Mon Mar 31 17:53:48 GMT 2025 , Edited by admin on Mon Mar 31 17:53:48 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY