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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H25BrO2
Molecular Weight 365.305
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6.BETA.-BROMOANDROSTENEDIONE

SMILES

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

InChI

InChIKey=HAWQRBIGKRAICT-DQXCSHPPSA-N
InChI=1S/C19H25BrO2/c1-18-7-5-11(21)9-15(18)16(20)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,12-14,16H,3-8,10H2,1-2H3/t12-,13-,14-,16+,18+,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H25BrO2
Molecular Weight 365.305
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:30:55 UTC 2023
Edited
by admin
on Sat Dec 16 13:30:55 UTC 2023
Record UNII
RJEYOWUDT6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6.BETA.-BROMOANDROSTENEDIONE
Common Name English
ANDROST-4-ENE-3,17-DIONE, 6.BETA.-BROMO-
Systematic Name English
(6.BETA.)-6-BROMOANDROST-4-ENE-3,17-DIONE
Systematic Name English
6.BETA.-BROMOANDROST-4-ENE-3,17-DIONE
Systematic Name English
ANDROST-4-ENE-3,17-DIONE, 6-BROMO-, (6.BETA.)-
Systematic Name English
Code System Code Type Description
CAS
38632-00-7
Created by admin on Sat Dec 16 13:30:56 UTC 2023 , Edited by admin on Sat Dec 16 13:30:56 UTC 2023
PRIMARY
PUBCHEM
161972
Created by admin on Sat Dec 16 13:30:56 UTC 2023 , Edited by admin on Sat Dec 16 13:30:56 UTC 2023
PRIMARY
FDA UNII
RJEYOWUDT6
Created by admin on Sat Dec 16 13:30:56 UTC 2023 , Edited by admin on Sat Dec 16 13:30:56 UTC 2023
PRIMARY
EPA CompTox
DTXSID10959474
Created by admin on Sat Dec 16 13:30:56 UTC 2023 , Edited by admin on Sat Dec 16 13:30:56 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
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ACTIVE MOIETY