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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H26O4
Molecular Weight 354.4394
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-KETO NORETHINDRONE ACETATE

SMILES

[H][C@@]12CC[C@@](OC(C)=O)(C#C)[C@@]1(C)CC[C@]3([H])[C@@]4([H])CCC(=O)C=C4C(=O)C[C@@]23[H]

InChI

InChIKey=VWZKIXMSPWEBCV-KYPKCDLESA-N
InChI=1S/C22H26O4/c1-4-22(26-13(2)23)10-8-19-17-12-20(25)18-11-14(24)5-6-15(18)16(17)7-9-21(19,22)3/h1,11,15-17,19H,5-10,12H2,2-3H3/t15-,16-,17-,19+,21+,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H26O4
Molecular Weight 354.4394
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:40:38 GMT 2023
Edited
by admin
on Sat Dec 16 10:40:38 GMT 2023
Record UNII
W7SN766M6T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-KETO NORETHINDRONE ACETATE
Common Name English
19-NORPREGN-4-EN-20-YNE-3,6-DIONE, 17-(ACETYLOXY)-, (17.ALPHA.)-
Systematic Name English
NORETHISTERONE ACETATE IMPURITY G [EP IMPURITY]
Common Name English
((8R,9S,10R,13S,14S,17R)-17-ETHYNYL-13-METHYL-3,6-DIOXO-2,7,8,9,10,11,12,14,15,16-DECAHYDRO-1H-CYCLOPENTA(A)PHENANTHREN-17-YL)ACETATE
Systematic Name English
Code System Code Type Description
FDA UNII
W7SN766M6T
Created by admin on Sat Dec 16 10:40:38 GMT 2023 , Edited by admin on Sat Dec 16 10:40:38 GMT 2023
PRIMARY
CAS
438244-27-0
Created by admin on Sat Dec 16 10:40:38 GMT 2023 , Edited by admin on Sat Dec 16 10:40:38 GMT 2023
PRIMARY
PUBCHEM
11428188
Created by admin on Sat Dec 16 10:40:38 GMT 2023 , Edited by admin on Sat Dec 16 10:40:38 GMT 2023
PRIMARY
RS_ITEM_NUM
1356213
Created by admin on Sat Dec 16 10:40:38 GMT 2023 , Edited by admin on Sat Dec 16 10:40:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID90465624
Created by admin on Sat Dec 16 10:40:38 GMT 2023 , Edited by admin on Sat Dec 16 10:40:38 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
sum of NORETHISTERONE ACETATE impurities D and G: maximum 0.2 per cent
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP