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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24O5S
Molecular Weight 376.467
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYNYLESTRADIOL 3-SULFATE

SMILES

[H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)CC[C@]3([H])C4=C(CC[C@@]23[H])C=C(OS(O)(=O)=O)C=C4

InChI

InChIKey=WLGIWVFFGMPRLM-SLHNCBLASA-N
InChI=1S/C20H24O5S/c1-3-20(21)11-9-18-17-6-4-13-12-14(25-26(22,23)24)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21H,4,6,8-11H2,2H3,(H,22,23,24)/t16-,17-,18+,19+,20+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ETHYNYLESTRADIOL 3-SULFATE
Common Name English
ETHYNYLESTRADIOL SULFATE
Common Name English
19-NORPREGNA-1,3,5(10)-TRIEN-20-YNE-3,17-DIOL, 3-(HYDROGEN SULFATE), (17.ALPHA.)-
Systematic Name English
17.ALPHA.-ETHYNYLESTRADIOL 3-SULFATE
Common Name English
Code System Code Type Description
FDA UNII
67P0FM71OZ
Created by admin on Sat Dec 16 08:48:43 GMT 2023 , Edited by admin on Sat Dec 16 08:48:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID80873219
Created by admin on Sat Dec 16 08:48:43 GMT 2023 , Edited by admin on Sat Dec 16 08:48:43 GMT 2023
PRIMARY
WIKIPEDIA
Ethinylestradiol sulfate
Created by admin on Sat Dec 16 08:48:43 GMT 2023 , Edited by admin on Sat Dec 16 08:48:43 GMT 2023
PRIMARY
PUBCHEM
68575
Created by admin on Sat Dec 16 08:48:43 GMT 2023 , Edited by admin on Sat Dec 16 08:48:43 GMT 2023
PRIMARY
CAS
24560-70-1
Created by admin on Sat Dec 16 08:48:43 GMT 2023 , Edited by admin on Sat Dec 16 08:48:43 GMT 2023
PRIMARY