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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H32O3
Molecular Weight 344.4877
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 17aβ-Hydroxy-6α,17aα-dimethyl-D-homoandrost-4-ene-3-17-dione

SMILES

[H][C@@]12C[C@H](C)C3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@@]4(C)[C@@]2([H])CCC(=O)[C@]4(C)O

InChI

InChIKey=QUOBGIIPSSNAMA-HOLMRGFLSA-N
InChI=1S/C22H32O3/c1-13-11-15-16(20(2)9-7-14(23)12-18(13)20)8-10-21(3)17(15)5-6-19(24)22(21,4)25/h12-13,15-17,25H,5-11H2,1-4H3/t13-,15+,16-,17-,20+,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H32O3
Molecular Weight 344.4877
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 Sat Dec 16 10:41:04 GMT 2023
Edited
by admin
on Sat Dec 16 10:41:04 GMT 2023
Record UNII
NP5SXY5EG3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
17aβ-Hydroxy-6α,17aα-dimethyl-D-homoandrost-4-ene-3-17-dione
Common Name English
MEDROXYPROGESTERONE ACETATE IMPURITY I [WHO-IP]
Common Name English
Code System Code Type Description
FDA UNII
NP5SXY5EG3
Created by admin on Sat Dec 16 10:41:04 GMT 2023 , Edited by admin on Sat Dec 16 10:41:04 GMT 2023
PRIMARY
PUBCHEM
71748992
Created by admin on Sat Dec 16 10:41:04 GMT 2023 , Edited by admin on Sat Dec 16 10:41:04 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
The following peaks are eluted at the following relative retention with reference to the peak of medroxyprogesterone acetate (retention time about 27 minutes): impurity I about 0.5. In the chromatogram obtained with solution (1):the area of any peak corresponding to impurity C, E or I is not greater than 2 times the area of the principal peak obtained with solution (3) (0.2%).