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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.BETA.-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-JUYLZWBTSA-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

Molecular Formula C21H28O3
Molecular Weight 328.4452
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 14:50:37 UTC 2023
Edited
by admin
on Sat Dec 16 14:50:37 UTC 2023
Record UNII
Y643AOR6HN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6.BETA.-HYDROXYLEVONORGESTREL
Common Name English
13-ETHYL-6.BETA.,17-DIHYDROXY-18,19-DINOR-17.ALPHA.-PREGN-4-EN-20-YN-3-ONE
Systematic Name English
18,19-DINORPREGN-4-EN-20-YN-3-ONE, 13-ETHYL-6,17-DIHYDROXY-, (6.BETA.,17.ALPHA.)-
Systematic Name English
LEVONORGESTREL IMPURITY H [EP IMPURITY]
Common Name English
(6.BETA.,17.ALPHA.)-13-ETHYL-6,17-DIHYDROXY-18,19-DINORPREGN-4-EN-20-YN-3-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
Y643AOR6HN
Created by admin on Sat Dec 16 14:50:38 UTC 2023 , Edited by admin on Sat Dec 16 14:50:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID80857731
Created by admin on Sat Dec 16 14:50:38 UTC 2023 , Edited by admin on Sat Dec 16 14:50:38 UTC 2023
PRIMARY
PUBCHEM
129318271
Created by admin on Sat Dec 16 14:50:38 UTC 2023 , Edited by admin on Sat Dec 16 14:50:38 UTC 2023
PRIMARY
CAS
55555-97-0
Created by admin on Sat Dec 16 14:50:38 UTC 2023 , Edited by admin on Sat Dec 16 14:50:38 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP