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Details

Stereochemistry ACHIRAL
Molecular Formula C21H30O2
Molecular Weight 314.4617
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ETHOXYANDROSTA-3,5-DIEN-17-ONE

SMILES

[H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC=C4C=C(CC[C@]34C)OCC

InChI

InChIKey=PAOWPNQOTVTCAF-OEUJLIAZSA-N
InChI=1S/C21H30O2/c1-4-23-15-9-11-20(2)14(13-15)5-6-16-17-7-8-19(22)21(17,3)12-10-18(16)20/h5,13,16-18H,4,6-12H2,1-3H3/t16-,17-,18-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H30O2
Molecular Weight 314.4617
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:21:57 UTC 2023
Edited
by admin
on Sat Dec 16 18:21:57 UTC 2023
Record UNII
W46ZAM53EN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-ETHOXYANDROSTA-3,5-DIEN-17-ONE
Systematic Name English
ANDROST-4-ENE-3,17-DIONE 3-ETHYL ENOL ETHER
Systematic Name English
ANDROSTA-3,5-DIEN-17-ONE, 3-ETHOXY-
Systematic Name English
TESTOSTERONE IMPURITY B [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
10358291
Created by admin on Sat Dec 16 18:21:57 UTC 2023 , Edited by admin on Sat Dec 16 18:21:57 UTC 2023
PRIMARY
CAS
972-46-3
Created by admin on Sat Dec 16 18:21:57 UTC 2023 , Edited by admin on Sat Dec 16 18:21:57 UTC 2023
PRIMARY
EPA CompTox
DTXSID20438705
Created by admin on Sat Dec 16 18:21:57 UTC 2023 , Edited by admin on Sat Dec 16 18:21:57 UTC 2023
PRIMARY
FDA UNII
W46ZAM53EN
Created by admin on Sat Dec 16 18:21:57 UTC 2023 , Edited by admin on Sat Dec 16 18:21:57 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP