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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H22O2
Molecular Weight 270.3661
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIENEDIONE

SMILES

[H][C@@]12CCC(=O)[C@@]1(C)CCC3=C4CCC(=O)C=C4CC[C@@]23[H]

InChI

InChIKey=BHTWZQKERRCPRZ-RYRKJORJSA-N
InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,15-16H,2-9H2,1H3/t15-,16+,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H22O2
Molecular Weight 270.3661
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Comparative in vitro metabolism of the 'designer' steroid estra-4,9-diene-3,17-dione between the equine, canine and human: identification of target metabolites for use in sports doping control.
2010 Oct
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:35:06 UTC 2023
Edited
by admin
on Sat Dec 16 09:35:06 UTC 2023
Record UNII
32XW5U770B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIENEDIONE
Common Name English
TRENA
Brand Name English
19-NOR-4,9(10)-ANDROSTADIENEDIONE
Common Name English
ESTRA-4,9-DIENE-3,17-DIONE
Systematic Name English
19-NORANDROSTA-4,9(10)-DIENE-3,17-DIONE
Common Name English
T-ROID
Brand Name English
ESTRA-4,9-DIENE-3,17-DIONE, (-)-
Systematic Name English
Classification Tree Code System Code
DEA NO. 4000
Created by admin on Sat Dec 16 09:35:06 UTC 2023 , Edited by admin on Sat Dec 16 09:35:06 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID10199676
Created by admin on Sat Dec 16 09:35:06 UTC 2023 , Edited by admin on Sat Dec 16 09:35:06 UTC 2023
PRIMARY
PUBCHEM
9835169
Created by admin on Sat Dec 16 09:35:06 UTC 2023 , Edited by admin on Sat Dec 16 09:35:06 UTC 2023
PRIMARY
FDA UNII
32XW5U770B
Created by admin on Sat Dec 16 09:35:06 UTC 2023 , Edited by admin on Sat Dec 16 09:35:06 UTC 2023
PRIMARY
CAS
5173-46-6
Created by admin on Sat Dec 16 09:35:06 UTC 2023 , Edited by admin on Sat Dec 16 09:35:06 UTC 2023
PRIMARY
WIKIPEDIA
Dienedione
Created by admin on Sat Dec 16 09:35:06 UTC 2023 , Edited by admin on Sat Dec 16 09:35:06 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY