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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H26O2
Molecular Weight 298.42
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMETHYLTRIENOLONE

SMILES

C[C@]1([H])CC2=CC(=O)CCC2=C3C=C[C@@]4(C)[C@@]([H])(CC[C@]4(C)O)[C@]13[H]

InChI

InChIKey=MEMDJKLEPFFNQS-ZGPIAVDESA-N
InChI=1S/C20H26O2/c1-12-10-13-11-14(21)4-5-15(13)16-6-8-19(2)17(18(12)16)7-9-20(19,3)22/h6,8,11-12,17-18,22H,4-5,7,9-10H2,1-3H3/t12-,17+,18-,19+,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H26O2
Molecular Weight 298.42
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 08:20:09 UTC 2021
Edited
by admin
on Sat Jun 26 08:20:09 UTC 2021
Record UNII
8GP0J5637H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIMETHYLTRIENOLONE
Common Name English
ESTR-4,9,11-TRIENE-3-ONE, 17.BETA.-HYDROXY-7.ALPHA., 17-DIMETHYL-
Common Name English
ESTRA-4,9,11-TRIEN-3-ONE, 17-HYDROXY-7,17-DIMETHYL-, (7.ALPHA.,17.BETA.)-
Common Name English
ESTRA-4,9,11-TRIEN-3-ONE, 17.BETA.-HYDROXY-7.ALPHA.,17-DIMETHYL-
Common Name English
RU-2420
Code English
Code System Code Type Description
PUBCHEM
101678228
Created by admin on Sat Jun 26 08:20:09 UTC 2021 , Edited by admin on Sat Jun 26 08:20:09 UTC 2021
PRIMARY
FDA UNII
8GP0J5637H
Created by admin on Sat Jun 26 08:20:09 UTC 2021 , Edited by admin on Sat Jun 26 08:20:09 UTC 2021
PRIMARY
CAS
10110-86-8
Created by admin on Sat Jun 26 08:20:09 UTC 2021 , Edited by admin on Sat Jun 26 08:20:09 UTC 2021
PRIMARY
Related Record Type Details
TARGET -> AGONIST
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY