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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24O3
Molecular Weight 312.4028
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHINYLESTRIOL

SMILES

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

InChI

InChIKey=VSODIPLKPBLGCC-NADOGSGZSA-N
InChI=1S/C20H24O3/c1-3-20(23)18(22)11-17-16-6-4-12-10-13(21)5-7-14(12)15(16)8-9-19(17,20)2/h1,5,7,10,15-18,21-23H,4,6,8-9,11H2,2H3/t15-,16-,17+,18-,19+,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H24O3
Molecular Weight 312.4028
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 Sat Dec 16 17:29:18 GMT 2023
Edited
by admin
on Sat Dec 16 17:29:18 GMT 2023
Record UNII
PVH6K749AL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHINYLESTRIOL
Common Name English
17-ETHYNYLESTRIOL
Systematic Name English
ESTRIOL, 17-ETHYNYL-
Systematic Name English
(16.ALPHA.,17.ALPHA.)-19-NORPREGNA-1,3,5(10)-TRIEN-20-YNE-3,16,17-TRIOL
Systematic Name English
19-NOR-17.ALPHA.-PREGNA-1,3,5(10)-TRIEN-20-YNE-3,16.ALPHA.,17-TRIOL
Systematic Name English
Code System Code Type Description
CAS
4717-40-2
Created by admin on Sat Dec 16 17:29:18 GMT 2023 , Edited by admin on Sat Dec 16 17:29:18 GMT 2023
PRIMARY
FDA UNII
PVH6K749AL
Created by admin on Sat Dec 16 17:29:18 GMT 2023 , Edited by admin on Sat Dec 16 17:29:18 GMT 2023
PRIMARY
PUBCHEM
11723045
Created by admin on Sat Dec 16 17:29:18 GMT 2023 , Edited by admin on Sat Dec 16 17:29:18 GMT 2023
PRIMARY
WIKIPEDIA
Ethinylestriol
Created by admin on Sat Dec 16 17:29:18 GMT 2023 , Edited by admin on Sat Dec 16 17:29:18 GMT 2023
PRIMARY
Related Record Type Details
PRODRUG -> METABOLITE ACTIVE