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

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H28O3
Molecular Weight 328.4452
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6.ALPHA.-HYDROXYLEVONORGESTREL

SMILES

[H][C@@]12CC[C@@](O)(C#C)[C@@]1(CC)CC[C@]3([H])[C@@]4([H])CCC(=O)C=C4[C@@H](O)C[C@@]23[H]

InChI

InChIKey=LUDPEOWAWHAHEP-QMSJUBBCSA-N
InChI=1S/C21H28O3/c1-3-20-9-7-15-14-6-5-13(22)11-17(14)19(23)12-16(15)18(20)8-10-21(20,24)4-2/h2,11,14-16,18-19,23-24H,3,5-10,12H2,1H3/t14-,15-,16-,18+,19+,20+,21+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
6.ALPHA.-HYDROXYLEVONORGESTREL
Common Name English
LEVONORGESTREL IMPURITY G [EP IMPURITY]
Common Name English
18,19-DINORPREGN-4-EN-20-YN-3-ONE, 13-ETHYL-6,17-DIHYDROXY-, (6.ALPHA.,17.ALPHA.)-
Systematic Name English
13-ETHYL-6.ALPHA.,17-DIHYDROXY-18,19-DINOR-17.ALPHA.-PREGN-4-EN-20-YN-3-ONE
Systematic Name English
Code System Code Type Description
CAS
87585-03-3
Created by admin on Sat Dec 16 10:37:56 GMT 2023 , Edited by admin on Sat Dec 16 10:37:56 GMT 2023
PRIMARY
FDA UNII
IDV1AQL73M
Created by admin on Sat Dec 16 10:37:56 GMT 2023 , Edited by admin on Sat Dec 16 10:37:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID20857730
Created by admin on Sat Dec 16 10:37:56 GMT 2023 , Edited by admin on Sat Dec 16 10:37:56 GMT 2023
PRIMARY
PUBCHEM
129318400
Created by admin on Sat Dec 16 10:37:56 GMT 2023 , Edited by admin on Sat Dec 16 10:37:56 GMT 2023
PRIMARY