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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H26O3
Molecular Weight 314.4186
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3-(Ethylenedioxy)estra-5(10),9(11)-dien-17-one

SMILES

C[C@]12CC=C3[C@@H](CCC4=C3CCC5(C4)OCCO5)[C@@H]1CCC2=O

InChI

InChIKey=XUOQKQRMICQUQC-AOIWGVFYSA-N
InChI=1S/C20H26O3/c1-19-8-6-15-14-7-9-20(22-10-11-23-20)12-13(14)2-3-16(15)17(19)4-5-18(19)21/h6,16-17H,2-5,7-12H2,1H3/t16-,17+,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H26O3
Molecular Weight 314.4186
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:32:37 GMT 2025
Edited
by admin
on Wed Apr 02 17:32:37 GMT 2025
Record UNII
2RAF5TL6V2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Estradiene dione-3-keta
Preferred Name English
3,3-(Ethylenedioxy)estra-5(10),9(11)-dien-17-one
Systematic Name English
Estra-5(10),9(11)-diene-3,17-dione, cyclic 3-(1,2-ethanediyl acetal)
Systematic Name English
Ethylene deltenone
Common Name English
Code System Code Type Description
CAS
5571-36-8
Created by admin on Wed Apr 02 17:32:37 GMT 2025 , Edited by admin on Wed Apr 02 17:32:37 GMT 2025
PRIMARY
EPA CompTox
DTXSID30427741
Created by admin on Wed Apr 02 17:32:37 GMT 2025 , Edited by admin on Wed Apr 02 17:32:37 GMT 2025
PRIMARY
FDA UNII
2RAF5TL6V2
Created by admin on Wed Apr 02 17:32:37 GMT 2025 , Edited by admin on Wed Apr 02 17:32:37 GMT 2025
PRIMARY
SMS_ID
300000052936
Created by admin on Wed Apr 02 17:32:37 GMT 2025 , Edited by admin on Wed Apr 02 17:32:37 GMT 2025
PRIMARY
PUBCHEM
7076399
Created by admin on Wed Apr 02 17:32:37 GMT 2025 , Edited by admin on Wed Apr 02 17:32:37 GMT 2025
PRIMARY