U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H34O3
Molecular Weight 358.5143
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-OXOPREGN-4-EN-20-YL ACETATE, (20R)-

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@@H](C)OC(C)=O

InChI

InChIKey=PXCKOQHPOYLYPE-KZJFZMNRSA-N
InChI=1S/C23H34O3/c1-14(26-15(2)24)19-7-8-20-18-6-5-16-13-17(25)9-11-22(16,3)21(18)10-12-23(19,20)4/h13-14,18-21H,5-12H2,1-4H3/t14-,18+,19-,20+,21+,22+,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H34O3
Molecular Weight 358.5143
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 18:30:34 GMT 2023
Edited
by admin
on Sat Dec 16 18:30:34 GMT 2023
Record UNII
AQ7QXF75PA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-OXOPREGN-4-EN-20-YL ACETATE, (20R)-
Systematic Name English
(20R)-3-OXOPREGN-4-EN-20-YL ACETATE
Systematic Name English
20-DIHYDROPROGESTERONE ACETATE
Common Name English
(20R)-20-(ACETYLOXY)PREGN-4-EN-3-ONE
Systematic Name English
20.BETA.-ACETOXYPREGN-4-EN-3-ONE
Systematic Name English
(20R)-ACETOXY-4-PREGNEN-3-ONE
Systematic Name English
PROGESTERONE IMPURITY E [EP IMPURITY]
Common Name English
PREGN-4-EN-3-ONE, 20-(ACETYLOXY)-, (20R)-
Systematic Name English
(1R)-1-((1S,3AS,3BS,9AR,9BS,11AS)-9A,11A-DIMETHYL-7-OXO-1H,2H,3H,3AH,3BH,4H,5H,7H,8H,9H,9AH,9BH,10H,11H,11AH-CYCLOPENTA(A)PHENANTHREN-1-YL)ETHYL ACETATE
Systematic Name English
Code System Code Type Description
FDA UNII
AQ7QXF75PA
Created by admin on Sat Dec 16 18:30:34 GMT 2023 , Edited by admin on Sat Dec 16 18:30:34 GMT 2023
PRIMARY
CAS
5062-62-4
Created by admin on Sat Dec 16 18:30:34 GMT 2023 , Edited by admin on Sat Dec 16 18:30:34 GMT 2023
PRIMARY
PUBCHEM
91741507
Created by admin on Sat Dec 16 18:30:34 GMT 2023 , Edited by admin on Sat Dec 16 18:30:34 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP