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

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H32O5
Molecular Weight 388.4972
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6.BETA.,17.BETA.-DIACETOXYANDROST-4-ENE-3-ONE

SMILES

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

InChI

InChIKey=UIYVZBDIGKEIAK-XZUVIMIXSA-N
InChI=1S/C23H32O5/c1-13(24)27-20-12-16-17-5-6-21(28-14(2)25)23(17,4)10-8-18(16)22(3)9-7-15(26)11-19(20)22/h11,16-18,20-21H,5-10,12H2,1-4H3/t16-,17-,18-,20+,21-,22+,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H32O5
Molecular Weight 388.4972
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 05:01:16 GMT 2023
Edited
by admin
on Sat Dec 16 05:01:16 GMT 2023
Record UNII
075X5E7OI5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6.BETA.,17.BETA.-DIACETOXYANDROST-4-ENE-3-ONE
Systematic Name English
ANDROST-4-EN-3-ONE, 6.BETA.,17.BETA.-DIHYDROXY-, DIACETATE
Common Name English
ANDROST-4-EN-3-ONE, 6,17-BIS(ACETYLOXY)-, (6.BETA.,17.BETA.)-
Systematic Name English
NSC-12205
Code English
6.BETA.,17.BETA.-DIHYDROXYANDROST-4-EN-3-ONE DIACETATE
Common Name English
Code System Code Type Description
PUBCHEM
224006
Created by admin on Sat Dec 16 05:01:17 GMT 2023 , Edited by admin on Sat Dec 16 05:01:17 GMT 2023
PRIMARY
NSC
12205
Created by admin on Sat Dec 16 05:01:17 GMT 2023 , Edited by admin on Sat Dec 16 05:01:17 GMT 2023
PRIMARY
FDA UNII
075X5E7OI5
Created by admin on Sat Dec 16 05:01:17 GMT 2023 , Edited by admin on Sat Dec 16 05:01:17 GMT 2023
PRIMARY
CAS
2098-51-3
Created by admin on Sat Dec 16 05:01:17 GMT 2023 , Edited by admin on Sat Dec 16 05:01:17 GMT 2023
PRIMARY