U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H28O4
Molecular Weight 356.4553
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Estradiol-3,17-diacetate

SMILES

[H][C@@]12CC[C@H](OC(C)=O)[C@@]1(C)CC[C@]3([H])C4=CC=C(OC(C)=O)C=C4CC[C@@]23[H]

InChI

InChIKey=VQHQLBARMFAKSV-AANPDWTMSA-N
InChI=1S/C22H28O4/c1-13(23)25-16-5-7-17-15(12-16)4-6-19-18(17)10-11-22(3)20(19)8-9-21(22)26-14(2)24/h5,7,12,18-21H,4,6,8-11H2,1-3H3/t18-,19-,20+,21+,22+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Estradiol-3,17-diacetate
Common Name English
Estra-1,3,5(10)-triene-3,17-diol (17β)-, diacetate
Systematic Name English
NSC-106559
Code English
Estra-1,3,5(10)-triene-3,17-diol (17β)-, 3,17-diacetate
Systematic Name English
Code System Code Type Description
NSC
106559
Created by admin on Sat Dec 16 18:33:51 GMT 2023 , Edited by admin on Sat Dec 16 18:33:51 GMT 2023
PRIMARY
FDA UNII
X43EU3CQ8P
Created by admin on Sat Dec 16 18:33:51 GMT 2023 , Edited by admin on Sat Dec 16 18:33:51 GMT 2023
PRIMARY
CAS
3434-88-6
Created by admin on Sat Dec 16 18:33:51 GMT 2023 , Edited by admin on Sat Dec 16 18:33:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID10955895
Created by admin on Sat Dec 16 18:33:51 GMT 2023 , Edited by admin on Sat Dec 16 18:33:51 GMT 2023
PRIMARY
WIKIPEDIA
Estradiol diacetate
Created by admin on Sat Dec 16 18:33:51 GMT 2023 , Edited by admin on Sat Dec 16 18:33:51 GMT 2023
PRIMARY
ECHA (EC/EINECS)
222-335-3
Created by admin on Sat Dec 16 18:33:51 GMT 2023 , Edited by admin on Sat Dec 16 18:33:51 GMT 2023
PRIMARY
PUBCHEM
66431
Created by admin on Sat Dec 16 18:33:51 GMT 2023 , Edited by admin on Sat Dec 16 18:33:51 GMT 2023
PRIMARY