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Details

Stereochemistry ACHIRAL
Molecular Formula C24H30O6
Molecular Weight 414.4914
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EPOXYDESONIDE

SMILES

CC1(C)O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)C46O[C@H]6C[C@]3(C)[C@@]2(O1)C(=O)CO

InChI

InChIKey=LAOLPAAORRPVAA-AEJQYYEJSA-N
InChI=1S/C24H30O6/c1-20(2)28-18-10-16-15-6-5-13-9-14(26)7-8-21(13,3)23(15)19(29-23)11-22(16,4)24(18,30-20)17(27)12-25/h7-9,15-16,18-19,25H,5-6,10-12H2,1-4H3/t15-,16-,18+,19-,21-,22-,23?,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H30O6
Molecular Weight 414.4914
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 7 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 12:35:38 GMT 2025
Edited
by admin
on Wed Apr 02 12:35:38 GMT 2025
Record UNII
DOA9DT6C7F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EPOXYDESONIDE [USP IMPURITY]
Preferred Name English
EPOXYDESONIDE
Common Name English
9,11.BETA.-EPOXY-21-HYDROXY-16.ALPHA.,17-(1-METHYLETHYLIDENEDIOXY)PREGNA-1,4-DIENE-3,20-DIONE
Systematic Name English
PREGNA-1,4-DIENE-3,20-DIONE, 9,11-EPOXY-21-HYDROXY-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (9.BETA.,11.BETA.,16.ALPHA.)-
Systematic Name English
Code System Code Type Description
PUBCHEM
162623677
Created by admin on Wed Apr 02 12:35:38 GMT 2025 , Edited by admin on Wed Apr 02 12:35:38 GMT 2025
PRIMARY
EPA CompTox
DTXSID801114739
Created by admin on Wed Apr 02 12:35:38 GMT 2025 , Edited by admin on Wed Apr 02 12:35:38 GMT 2025
PRIMARY
FDA UNII
DOA9DT6C7F
Created by admin on Wed Apr 02 12:35:38 GMT 2025 , Edited by admin on Wed Apr 02 12:35:38 GMT 2025
PRIMARY
CAS
39672-75-8
Created by admin on Wed Apr 02 12:35:38 GMT 2025 , Edited by admin on Wed Apr 02 12:35:38 GMT 2025
PRIMARY
Related Record Type Details
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CHROMATOGRAPHIC PURITY (HPLC/UV)
USP