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Details

Stereochemistry ACHIRAL
Molecular Formula C28H24O6
Molecular Weight 456.4866
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of FUROSTILBESTROL

SMILES

CC\C(=C(\CC)C1=CC=C(OC(=O)C2=CC=CO2)C=C1)C3=CC=C(OC(=O)C4=CC=CO4)C=C3

InChI

InChIKey=VUDMUAVGKIZQRY-WCWDXBQESA-N
InChI=1S/C28H24O6/c1-3-23(19-9-13-21(14-10-19)33-27(29)25-7-5-17-31-25)24(4-2)20-11-15-22(16-12-20)34-28(30)26-8-6-18-32-26/h5-18H,3-4H2,1-2H3/b24-23+

HIDE SMILES / InChI

Molecular Formula C28H24O6
Molecular Weight 456.4866
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Description
Curator's Comment: Some info from https://en.wikipedia.org/wiki/Furostilbestrol because scientific literature on Furostilbestrol not found or not accessible.

Furostilbestrol (diethylstilbestrol di(2-furoate)) is a synthetic estrogen that was first described in 1952. It is an ester of diethylstilbestrol (DES), a synthetic estrogen that was prescribed to pregnant women until 1971 to prevent miscarriages and that has been associated with cancer, birth defects and several other developmental abnormalities. Furostilbestrol was never marketed.

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:30:06 UTC 2023
Edited
by admin
on Fri Dec 15 15:30:06 UTC 2023
Record UNII
JN9M0YN4VL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FUROSTILBESTROL
INN  
INN  
Official Name English
.ALPHA.,.ALPHA.'-DIETHYL-4,4'-STILBENEDIOL DI-2-FUROATE
Common Name English
furostilbestrol [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C2182
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID10862171
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
INN
194
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
ChEMBL
CHEMBL2105117
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
WIKIPEDIA
Furostilbestrol
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
PUBCHEM
5930604
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
EVMPD
SUB07850MIG
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
SMS_ID
100000084484
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
NCI_THESAURUS
C65790
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
CAS
549-40-6
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
ECHA (EC/EINECS)
208-965-1
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
FDA UNII
JN9M0YN4VL
Created by admin on Fri Dec 15 15:30:06 UTC 2023 , Edited by admin on Fri Dec 15 15:30:06 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY