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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H22O2
Molecular Weight 270.3661
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-ISOESTRONE

SMILES

C[C@]12CC[C@H]3[C@H](CCC4=C3C=CC(O)=C4)[C@@H]1CCC2=O

InChI

InChIKey=DNXHEGUUPJUMQT-CVYDXHPNSA-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/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15+,16+,18+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
1,3,5-8.ALPHA.-EPIESTRATRIEN-17-ONE-3-OL
Preferred Name English
8-ISOESTRONE
MI  
Common Name English
ISOESTRONE
Common Name English
ESTRA-1,3,5(10)-TRIEN-17-ONE, 3-HYDROXY-, (8.ALPHA.)-
Systematic Name English
8-EPIESTRONE
Common Name English
8.ALPHA.-ESTRONE
Common Name English
8-ISOESTRONE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m6483
Created by admin on Mon Mar 31 22:53:06 GMT 2025 , Edited by admin on Mon Mar 31 22:53:06 GMT 2025
PRIMARY Merck Index
CAS
517-06-6
Created by admin on Mon Mar 31 22:53:06 GMT 2025 , Edited by admin on Mon Mar 31 22:53:06 GMT 2025
PRIMARY
FDA UNII
SE9LJV29ZO
Created by admin on Mon Mar 31 22:53:06 GMT 2025 , Edited by admin on Mon Mar 31 22:53:06 GMT 2025
PRIMARY
PUBCHEM
9547221
Created by admin on Mon Mar 31 22:53:06 GMT 2025 , Edited by admin on Mon Mar 31 22:53:06 GMT 2025
PRIMARY