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Details

Stereochemistry MIXED
Molecular Formula C30H48N2O2
Molecular Weight 468.7143
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHYLAMINOETHOXYHEXESTROL

SMILES

CCC(C(CC)C1=CC=C(OCCN(CC)CC)C=C1)C2=CC=C(OCCN(CC)CC)C=C2

InChI

InChIKey=UBDWKOZBPSKHMO-UHFFFAOYSA-N
InChI=1S/C30H48N2O2/c1-7-29(25-13-17-27(18-14-25)33-23-21-31(9-3)10-4)30(8-2)26-15-19-28(20-16-26)34-24-22-32(11-5)12-6/h13-20,29-30H,7-12,21-24H2,1-6H3

HIDE SMILES / InChI
Molecular Formula C30H48N2O2
Molecular Weight 468.7143
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Description

Diethylaminoethoxyhexestrol is a coronary dilating agent, approved for the treatment of angina in 1958 and marketed under tradename Coralgil. Diethylaminoethoxyhexestrol was withdrawn from the market because of drug-related phospholipidosis in liver, spleen and other tissues. Studies indicate that lipidosis is caused by the accumulation of the drug in lysosomes and inhibition of phospholipase A.

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:37:39 GMT 2025
Edited
by admin
on Mon Mar 31 22:37:39 GMT 2025
Record UNII
UBR09A3IFF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-BIS(P-(.BETA.-DIETHYLAMINOETHOXY)PHENYL)HEXANE
Preferred Name English
DIETHYLAMINOETHOXYHEXESTROL
Common Name English
HEXESTROL BIS(.BETA.-DIETHYLAMINOETHYL) ETHER
Common Name English
4,4'-DIETHYLAMINOETHOXYHEXESTROL
Common Name English
HEXESTROL BIS(.BETA.-DIETHYLAMINOETHYL ETHER) [MI]
Common Name English
4,4'-BIS(2-DIETHYLAMINOETHOXY)-.ALPHA.,.ALPHA.'-DIETHYLBIBENZYL
Systematic Name English
4,4'-BIS(.BETA.-DIETHYLAMINOETHOXY)-.ALPHA.,.BETA.-DIETHYLDIPHENYLETHANE
Common Name English
4,4'-BIS(.BETA.-DIETHYLAMINOETHOXY)HEXESTROL
Common Name English
TRIETHYLAMINE, 2,2'''-((1,2-DIETHYLETHYLENE)BIS(P-PHENYLENEOXY))BIS-
Systematic Name English
2,2'-(3,4-HEXANEDIYLBIS(4,1-PHENYLENEOXY))-BIS(N,N-DIETHYLETHANAMINE)
Systematic Name English
ETHANAMINE, 2,2'-((1,2-DIETHYL-1,2-ETHANEDIYL)BIS(4,1-PHENYLENEOXY))BIS(N,N-DIETHYL-
Systematic Name English
Code System Code Type Description
MERCK INDEX
m6008
Created by admin on Mon Mar 31 22:37:39 GMT 2025 , Edited by admin on Mon Mar 31 22:37:39 GMT 2025
PRIMARY Merck Index
ECHA (EC/EINECS)
220-261-6
Created by admin on Mon Mar 31 22:37:39 GMT 2025 , Edited by admin on Mon Mar 31 22:37:39 GMT 2025
PRIMARY
FDA UNII
UBR09A3IFF
Created by admin on Mon Mar 31 22:37:39 GMT 2025 , Edited by admin on Mon Mar 31 22:37:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID40871539
Created by admin on Mon Mar 31 22:37:39 GMT 2025 , Edited by admin on Mon Mar 31 22:37:39 GMT 2025
PRIMARY
DRUG CENTRAL
3276
Created by admin on Mon Mar 31 22:37:39 GMT 2025 , Edited by admin on Mon Mar 31 22:37:39 GMT 2025
PRIMARY
PUBCHEM
66143
Created by admin on Mon Mar 31 22:37:39 GMT 2025 , Edited by admin on Mon Mar 31 22:37:39 GMT 2025
PRIMARY
CAS
2691-45-4
Created by admin on Mon Mar 31 22:37:39 GMT 2025 , Edited by admin on Mon Mar 31 22:37:39 GMT 2025
PRIMARY
Related Record Type Details
Structure of DIETHYLAMINOETHOXYHEXESTROL
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NIH
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