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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H26O3
Molecular Weight 326.4293
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6?-Hydroxy-gestodene

SMILES

CC[C@]12CC[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@H]34)[C@@H]1C=C[C@@]2(O)C#C

InChI

InChIKey=JCWGEBKVGXGDSI-JUYLZWBTSA-N
InChI=1S/C21H26O3/c1-3-20-9-7-15-14-6-5-13(22)11-17(14)19(23)12-16(15)18(20)8-10-21(20,24)4-2/h2,8,10-11,14-16,18-19,23-24H,3,5-7,9,12H2,1H3/t14-,15-,16-,18+,19-,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H26O3
Molecular Weight 326.4293
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:02:50 GMT 2025
Edited
by admin
on Wed Apr 02 18:02:50 GMT 2025
Record UNII
W6LP24XA9Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GESTODENE IMPURITY D [EP IMPURITY]
Preferred Name English
6?-Hydroxy-gestodene
Common Name English
(6R,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-6,17-dihydroxy-1,2,6,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthren-3-one
Systematic Name English
13-ethyl-6?,17-dihydroxy-18,19-dinor-17?-pregna-4,15-dien-20-yn-3-one
Systematic Name English
Code System Code Type Description
FDA UNII
W6LP24XA9Y
Created by admin on Wed Apr 02 18:02:50 GMT 2025 , Edited by admin on Wed Apr 02 18:02:50 GMT 2025
PRIMARY
PUBCHEM
89704395
Created by admin on Wed Apr 02 18:02:50 GMT 2025 , Edited by admin on Wed Apr 02 18:02:50 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY