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

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H26O2
Molecular Weight 310.4299
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 17-KETO DROSPIRENONE

SMILES

[H][C@]12C[C@@]1([H])[C@@]3([H])[C@]4([H])[C@@]5([H])C[C@@]5([H])C6=CC(=O)CC[C@]6(C)[C@@]4([H])CC[C@]3(C)C2=O

InChI

InChIKey=VGUTUSVKXLWMPF-RZSXWSLZSA-N
InChI=1S/C21H26O2/c1-20-5-3-10(22)7-16(20)11-8-12(11)17-15(20)4-6-21(2)18(17)13-9-14(13)19(21)23/h7,11-15,17-18H,3-6,8-9H2,1-2H3/t11-,12+,13-,14+,15+,17-,18+,20-,21+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
17-KETO DROSPIRENONE
Common Name English
DROSPIRENONE IMPURITY, 17-KETO DROSPIRENONE- [USP IMPURITY]
Common Name English
6.BETA.,7.BETA.:15.BETA.,16.BETA.-DIMETHYLENEANDROST-4-ENE-3,17-DIONE
Common Name English
DROSPIRENONE IMPURITY C
EP  
Common Name English
1H-DICYCLOPROPA(6,7:15,16)CYCLOPENTA(A)PHENANTHRENE-3,17(2H,10H)-DIONE, 6,7,8,9,11,12,13,14,15,16,20,21-DODECAHYDRO-10,13-DIMETHYL-, (6R,7R,8R,9S,10R,13S,14S,15S,16S)-
Common Name English
DROSPIRENONE IMPURITY C [EP IMPURITY]
Common Name English
1H-DICYCLOPROPA(6,7:15,16)CYCLOPENTA(A)PHENANTHRENE-3,17(2H,10H)-DIONE, 6,7,8,9,11,12,13,14,15,16,20,21-DODECAHYDRO-10,13-DIMETHYL-, (6R-(6.ALPHA.,7.ALPHA.,8.BETA.,9.ALPHA.,10.ALPHA.,13.BETA.,14.ALPHA.,15.ALPHA.,16.ALPHA.))-
Common Name English
Code System Code Type Description
FDA UNII
Q37FDQ515T
Created by admin on Sat Dec 16 05:00:43 GMT 2023 , Edited by admin on Sat Dec 16 05:00:43 GMT 2023
PRIMARY
CAS
116298-21-6
Created by admin on Sat Dec 16 05:00:43 GMT 2023 , Edited by admin on Sat Dec 16 05:00:43 GMT 2023
PRIMARY
PUBCHEM
71587433
Created by admin on Sat Dec 16 05:00:43 GMT 2023 , Edited by admin on Sat Dec 16 05:00:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID70151336
Created by admin on Sat Dec 16 05:00:43 GMT 2023 , Edited by admin on Sat Dec 16 05:00:43 GMT 2023
PRIMARY