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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H40O4
Molecular Weight 404.5827
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5.ALPHA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL DIPROPIONATE

SMILES

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

InChI

InChIKey=FWAYUWSHYLKUEY-LFWYWRBCSA-N
InChI=1S/C25H40O4/c1-5-22(26)28-17-11-13-24(3)16(15-17)7-8-18-19-9-10-21(29-23(27)6-2)25(19,4)14-12-20(18)24/h16-21H,5-15H2,1-4H3/t16-,17+,18-,19-,20-,21-,24-,25-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
5.ALPHA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL DIPROPIONATE
Systematic Name English
NSC-23758
Preferred Name English
ANDROSTANE-3,17-DIOL, 3,17-DIPROPANOATE, (3.ALPHA.,5.ALPHA.,17.BETA.)-
Systematic Name English
5.ALPHA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL, DIPROPIONATE
Systematic Name English
Code System Code Type Description
NSC
23758
Created by admin on Mon Mar 31 21:57:05 GMT 2025 , Edited by admin on Mon Mar 31 21:57:05 GMT 2025
PRIMARY
CAS
4350-14-5
Created by admin on Mon Mar 31 21:57:05 GMT 2025 , Edited by admin on Mon Mar 31 21:57:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID10963016
Created by admin on Mon Mar 31 21:57:05 GMT 2025 , Edited by admin on Mon Mar 31 21:57:05 GMT 2025
PRIMARY
PUBCHEM
134572
Created by admin on Mon Mar 31 21:57:05 GMT 2025 , Edited by admin on Mon Mar 31 21:57:05 GMT 2025
PRIMARY
FDA UNII
S1GK360608
Created by admin on Mon Mar 31 21:57:05 GMT 2025 , Edited by admin on Mon Mar 31 21:57:05 GMT 2025
PRIMARY