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

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H22O2
Molecular Weight 210.3126
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-ETHYL-3-METHYL-2-(3-OXOBUTYL)CYCLOHEXANONE, (2S,3R,6R)-

SMILES

CC[C@@H]1CC[C@@H](C)[C@H](CCC(C)=O)C1=O

InChI

InChIKey=DYGZNDLZBYIWGA-JLLWLGSASA-N
InChI=1S/C13H22O2/c1-4-11-7-5-9(2)12(13(11)15)8-6-10(3)14/h9,11-12H,4-8H2,1-3H3/t9-,11-,12+/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
6-ETHYL-3-METHYL-2-(3-OXOBUTYL)CYCLOHEXANONE, (2S,3R,6R)-
Systematic Name English
DIHYDROARTEMISININ IMPURITY H
Preferred Name English
CYCLOHEXANONE, 6-ETHYL-3-METHYL-2-(3-OXOBUTYL)-, (2S,3R,6R)-
Systematic Name English
(3R)-6-ETHYL-3-METHYL-2-(3-OXOBUTYL)CYCLOHEXANONE
Systematic Name English
Code System Code Type Description
CAS
958447-27-3
Created by admin on Mon Mar 31 21:57:09 GMT 2025 , Edited by admin on Mon Mar 31 21:57:09 GMT 2025
PRIMARY
FDA UNII
A1S8MHU69N
Created by admin on Mon Mar 31 21:57:09 GMT 2025 , Edited by admin on Mon Mar 31 21:57:09 GMT 2025
PRIMARY
PUBCHEM
24741988
Created by admin on Mon Mar 31 21:57:09 GMT 2025 , Edited by admin on Mon Mar 31 21:57:09 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966