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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H30O4
Molecular Weight 382.4926
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (1?,2?)-17-(Acetyloxy)-1,2-dihydro-3?H-cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione

SMILES

CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=CC4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@]12C)C(C)=O

InChI

InChIKey=ARUYPSAYKHCXNE-UQNNAPNASA-N
InChI=1S/C24H30O4/c1-13(25)24(28-14(2)26)10-8-18-16-6-5-15-11-21(27)17-12-20(17)23(15,4)19(16)7-9-22(18,24)3/h5-6,11,16-20H,7-10,12H2,1-4H3/t16-,17+,18-,19-,20-,22-,23-,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H30O4
Molecular Weight 382.4926
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:36:16 GMT 2025
Edited
by admin
on Wed Apr 02 17:36:16 GMT 2025
Record UNII
689QR3QTC2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYPROTERONE ACETATE IMPURITY A [EP IMPURITY]
Preferred Name English
(1?,2?)-17-(Acetyloxy)-1,2-dihydro-3?H-cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione
Systematic Name English
3?H-Cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-1,2-dihydro-, (1?,2?)-
Systematic Name English
17-Hydroxy-1?,2?-methylenepregna-4,6-diene-3,20-dione acetate
Systematic Name English
3,20-dioxo-1?,2?-dihydro-3?H-cyclopropa[1,2]pregna-1,4,6-trien-17-yl acetate
Systematic Name English
Code System Code Type Description
PUBCHEM
13519086
Created by admin on Wed Apr 02 17:36:16 GMT 2025 , Edited by admin on Wed Apr 02 17:36:16 GMT 2025
PRIMARY
CAS
2701-50-0
Created by admin on Wed Apr 02 17:36:16 GMT 2025 , Edited by admin on Wed Apr 02 17:36:16 GMT 2025
PRIMARY
FDA UNII
689QR3QTC2
Created by admin on Wed Apr 02 17:36:16 GMT 2025 , Edited by admin on Wed Apr 02 17:36:16 GMT 2025
PRIMARY
EPA CompTox
DTXSID201129275
Created by admin on Wed Apr 02 17:36:16 GMT 2025 , Edited by admin on Wed Apr 02 17:36:16 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY