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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H30O5
Molecular Weight 386.4813
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 17?-Acetoxy-6-hydroxymethyl-3,20-dioxo-19-nor-pregna-4,6-diene

SMILES

CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(CO)C4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C(C)=O

InChI

InChIKey=ZYBJYPZVKRMJHY-YQLZSBIMSA-N
InChI=1S/C23H30O5/c1-13(25)23(28-14(2)26)9-7-21-20-10-15(12-24)19-11-16(27)4-5-17(19)18(20)6-8-22(21,23)3/h10-11,17-18,20-21,24H,4-9,12H2,1-3H3/t17-,18-,20-,21+,22+,23+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Nomegestrol acetate 6-hydroxy impurity
Preferred Name English
17?-Acetoxy-6-hydroxymethyl-3,20-dioxo-19-nor-pregna-4,6-diene
Systematic Name English
Nomegestrol acetate 6-hydroxy metabolite
Common Name English
19-Norpregna-4,6-diene-3,20-dione, 17-(acetyloxy)-6-(hydroxymethyl)-
Systematic Name English
TX-219
Common Name English
Code System Code Type Description
CAS
147508-44-9
Created by admin on Wed Apr 02 17:45:48 GMT 2025 , Edited by admin on Wed Apr 02 17:45:48 GMT 2025
PRIMARY
FDA UNII
YC98W76BX8
Created by admin on Wed Apr 02 17:45:48 GMT 2025 , Edited by admin on Wed Apr 02 17:45:48 GMT 2025
PRIMARY
PUBCHEM
18664612
Created by admin on Wed Apr 02 17:45:48 GMT 2025 , Edited by admin on Wed Apr 02 17:45:48 GMT 2025
PRIMARY