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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H22O2
Molecular Weight 270.3661
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESTROXIDE

SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@H]5O[C@@H]25

InChI

InChIKey=XPXOJYZDBJGFEI-PNVOZDDCSA-N
InChI=1S/C18H22O2/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16-17(18)20-16/h3,5,8,13-17,19H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17-,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H22O2
Molecular Weight 270.3661
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 12:05:23 GMT 2025
Edited
by admin
on Wed Apr 02 12:05:23 GMT 2025
Record UNII
214494O1DQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ESTROXIDE
Common Name English
(16.ALPHA.,17.ALPHA.)-16,17-EPOXYESTRA-1,3,5(10)-TRIEN-3-OL
Preferred Name English
ESTRA-1,3,5(10)-TRIEN-3-OL, 16,17-EPOXY-, (16.ALPHA.,17.ALPHA.)-
Systematic Name English
ESTRA-1,3,5(10)-TRIEN-3-OL, 16.ALPHA.,17.ALPHA.-EPOXY-
Systematic Name English
Code System Code Type Description
PUBCHEM
94148
Created by admin on Wed Apr 02 12:05:23 GMT 2025 , Edited by admin on Wed Apr 02 12:05:23 GMT 2025
PRIMARY
CAS
74299-42-6
Created by admin on Wed Apr 02 12:05:23 GMT 2025 , Edited by admin on Wed Apr 02 12:05:23 GMT 2025
SUPERSEDED
CAS
472-56-0
Created by admin on Wed Apr 02 12:05:23 GMT 2025 , Edited by admin on Wed Apr 02 12:05:23 GMT 2025
PRIMARY
FDA UNII
214494O1DQ
Created by admin on Wed Apr 02 12:05:23 GMT 2025 , Edited by admin on Wed Apr 02 12:05:23 GMT 2025
PRIMARY
EPA CompTox
DTXSID00963767
Created by admin on Wed Apr 02 12:05:23 GMT 2025 , Edited by admin on Wed Apr 02 12:05:23 GMT 2025
PRIMARY