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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H24O2
Molecular Weight 290.417
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyltrienolone H-3

SMILES

[H][C@@]12CC[C@@](O)(C([3H])([3H])[3H])[C@@]1(C)C=CC3=C4CCC(=O)C=C4CC[C@@]23[H]

InChI

InChIKey=CCCIJQPRIXGQOE-JSRHFANGSA-N
InChI=1S/C19H24O2/c1-18-9-7-15-14-6-4-13(20)11-12(14)3-5-16(15)17(18)8-10-19(18,2)21/h7,9,11,16-17,21H,3-6,8,10H2,1-2H3/t16-,17+,18+,19+/m1/s1/i2T3

HIDE SMILES / InChI

Molecular Formula C19H24O2
Molecular Weight 290.417
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:19:04 GMT 2023
Edited
by admin
on Sat Dec 16 20:19:04 GMT 2023
Record UNII
A4TL3XLM32
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyltrienolone H-3
Common Name English
Estra-4,9,11-trien-3-one, 17-hydroxy-17-(methyl-t3)-, (17β)-
Systematic Name English
[3H]Methyltrienolone
Common Name English
Code System Code Type Description
CAS
72272-76-5
Created by admin on Sat Dec 16 20:19:05 GMT 2023 , Edited by admin on Sat Dec 16 20:19:05 GMT 2023
PRIMARY
FDA UNII
A4TL3XLM32
Created by admin on Sat Dec 16 20:19:05 GMT 2023 , Edited by admin on Sat Dec 16 20:19:05 GMT 2023
PRIMARY
Related Record Type Details
TARGET->RADIOLIGAND
Kd
NON-LABELED -> LABELED