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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H22O4
Molecular Weight 254.3221
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.,4-DIMETHYL-2-OXO-3-(3-OXOBUTYL)CYCLOHEXANEACETIC ACID, (.ALPHA.R,1S,3S,4R)-

SMILES

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

InChI

InChIKey=SRIAUFRKRAJBGZ-YJQGPUDQSA-N
InChI=1S/C14H22O4/c1-8-4-6-12(10(3)14(17)18)13(16)11(8)7-5-9(2)15/h8,10-12H,4-7H2,1-3H3,(H,17,18)/t8-,10-,11+,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula C14H22O4
Molecular Weight 254.3221
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 08:29:46 UTC 2023
Edited
by admin
on Sat Dec 16 08:29:46 UTC 2023
Record UNII
98Z8M20H81
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.,4-DIMETHYL-2-OXO-3-(3-OXOBUTYL)CYCLOHEXANEACETIC ACID, (.ALPHA.R,1S,3S,4R)-
Common Name English
DIHYDROARTEMISININ IMPURITY F
Common Name English
2-((4R)-4-METHYL-2-OXO-3-(3-OXOBUTYL)CYCLOHEXYL)PROPIONIC ACID
Systematic Name English
CYCLOHEXANEACETIC ACID, .ALPHA.,4-DIMETHYL-2-OXO-3-(3-OXOBUTYL)-, (1S-(1.ALPHA.(S*),3.ALPHA.,4.BETA.))-
Systematic Name English
CYCLOHEXANEACETIC ACID, .ALPHA.,4-DIMETHYL-2-OXO-3-(3-OXOBUTYL)-, (.ALPHA.R,1S,3S,4R)-
Common Name English
Code System Code Type Description
PUBCHEM
21575634
Created by admin on Sat Dec 16 08:29:46 UTC 2023 , Edited by admin on Sat Dec 16 08:29:46 UTC 2023
PRIMARY
CAS
173427-03-7
Created by admin on Sat Dec 16 08:29:46 UTC 2023 , Edited by admin on Sat Dec 16 08:29:46 UTC 2023
PRIMARY
FDA UNII
98Z8M20H81
Created by admin on Sat Dec 16 08:29:46 UTC 2023 , Edited by admin on Sat Dec 16 08:29:46 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY