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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H28O2
Molecular Weight 312.4458
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TETRAHYDROGESTRINONE

SMILES

[H][C@@]12CC[C@@](O)(CC)[C@@]1(CC)C=CC3=C4CCC(=O)C=C4CC[C@@]23[H]

InChI

InChIKey=OXHNQTSIKGHVBH-ANULTFPQSA-N
InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h9,11,13,18-19,23H,3-8,10,12H2,1-2H3/t18-,19+,20+,21+/m1/s1

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
Name Type Language
TETRAHYDROGESTRINONE
MI  
Common Name English
13.BETA.,17.ALPHA.-DIETHYL-17.BETA.-HYDROXYGON-4,9,11-TRIEN-3-ONE
Systematic Name English
18,19-DINORPREGNA-4,9,11-TRIEN-3-ONE, 13-ETHYL-17-HYDROXY-, (17.ALPHA.)-
Systematic Name English
TETRAHYDROGESTRINONE [MI]
Common Name English
THG
Common Name English
(17.ALPHA.)-13-ETHYL-17-HYDROXY-18,19-DINORPREGNA-4,9,11-TRIEN-3-ONE
Systematic Name English
Classification Tree Code System Code
WIKIPEDIA Designer-drugs-Tetrahydrogestrinone
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
DEA NO. 4000
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
Code System Code Type Description
FDA UNII
643MR6L9LB
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
PRIMARY
MERCK INDEX
m10629
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID60210901
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
PRIMARY
CAS
618903-56-3
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
PRIMARY
PUBCHEM
6857686
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
PRIMARY
DRUG BANK
DB06870
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
PRIMARY
WIKIPEDIA
Tetrahydrogestrinone
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
PRIMARY
SMS_ID
300000036282
Created by admin on Sat Dec 16 07:55:38 GMT 2023 , Edited by admin on Sat Dec 16 07:55:38 GMT 2023
PRIMARY