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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22O5
Molecular Weight 282.3322
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-EPIARTEMISININ

SMILES

[H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(OC(=O)[C@H]2C)O4

InChI

InChIKey=BLUAFEHZUWYNDE-DWIPZSBTSA-N
InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9+,10+,11+,13-,14-,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H22O5
Molecular Weight 282.3322
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:37:52 UTC 2023
Edited
by admin
on Sat Dec 16 08:37:52 UTC 2023
Record UNII
0474Z7MDH1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9-EPIARTEMISININ
Common Name English
(3R,5AS,6R,8AS,9S,12S,12AR)-OCTAHYDRO-3,6,9-TRIMETHYL-3,12-EPOXY-12H-PYRANO(4,3-J)-1,2-BENZODIOXEPIN-10(3H)-ONE
Systematic Name English
(+)-9-EPIARTEMISININ
Common Name English
9-EPI-ARTEMISININ [WHO-IP]
Common Name English
3,12-EPOXY-12H-PYRANO(4,3-J)-1,2-BENZODIOXEPIN-10(3H)-ONE, OCTAHYDRO-3,6,9-TRIMETHYL-, (3R-(3.ALPHA.,5A.BETA.,6.BETA.,8A.BETA.,9.BETA.,12.BETA.,12AR*))-
Systematic Name English
3,12-EPOXY-12H-PYRANO(4,3-J)-1,2-BENZODIOXEPIN-10(3H)-ONE, OCTAHYDRO-3,6,9-TRIMETHYL-, (3R,5AS,6R,8AS,9S,12S,12AR)-
Systematic Name English
11-EPI-ARTEMISININ
Common Name English
Code System Code Type Description
CAS
113472-97-2
Created by admin on Sat Dec 16 08:37:52 UTC 2023 , Edited by admin on Sat Dec 16 08:37:52 UTC 2023
PRIMARY
FDA UNII
0474Z7MDH1
Created by admin on Sat Dec 16 08:37:52 UTC 2023 , Edited by admin on Sat Dec 16 08:37:52 UTC 2023
PRIMARY
EPA CompTox
DTXSID70356309
Created by admin on Sat Dec 16 08:37:52 UTC 2023 , Edited by admin on Sat Dec 16 08:37:52 UTC 2023
PRIMARY
PUBCHEM
821423
Created by admin on Sat Dec 16 08:37:52 UTC 2023 , Edited by admin on Sat Dec 16 08:37:52 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
In the chromatogram obtained with solution (1): - the area of any peak corresponding to impurity B is not greater than 0.3 times the area of the principal peak in the chromatogram obtained with solution (3) (0.3%).
CHROMATOGRAPHIC PURITY (HPLC/UV)