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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H32O2.H2O
Molecular Weight 358.5143
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMETHISTERONE

SMILES

O.[H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])C[C@H](C)C4=CC(=O)CC[C@]34C

InChI

InChIKey=REHJTMDOJHAPJV-IVTQUDKZSA-N
InChI=1S/C23H32O2.H2O/c1-5-9-23(25)12-8-19-17-13-15(2)20-14-16(24)6-10-21(20,3)18(17)7-11-22(19,23)4;/h14-15,17-19,25H,6-8,10-13H2,1-4H3;1H2/t15-,17+,18-,19-,21+,22-,23-;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DIMETHISTERONE
JAN   MI   USAN  
USAN  
Official Name English
17β-Hydroxy-6-α-methyl-17-(1-propynyl)androst-4-en-3-one monohydrate
Common Name English
DIMETHISTERONE [JAN]
Common Name English
DIMETHISTERONE MONOHYDRATE [MI]
Common Name English
ANDROST-4-EN-3-ONE, 17-HYDROXY-6-METHYL-17-(1-PROPYNYL)-, MONOHYDRATE, (6.ALPHA.,17.BETA.)-
Common Name English
DIMETHISTERONE [USAN]
Common Name English
5048
Code English
Classification Tree Code System Code
NCI_THESAURUS C776
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
Code System Code Type Description
SMS_ID
100000082662
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
PUBCHEM
65320
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
EPA CompTox
DTXSID30194305
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
WIKIPEDIA
DIMETHISTERONE
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
NCI_THESAURUS
C65404
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
MERCK INDEX
m4510
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY Merck Index
MESH
D004116
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
DRUG CENTRAL
904
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
ChEMBL
CHEMBL2106347
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
FDA UNII
K4MZ02M175
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY
CAS
41354-30-7
Created by admin on Fri Dec 15 14:59:25 UTC 2023 , Edited by admin on Fri Dec 15 14:59:25 UTC 2023
PRIMARY