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CHEBI:168754 - Dihydroartemisinin (DHA)

ChEBI IDCHEBI:168754
ChEBI NameDihydroartemisinin (DHA)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O5
Net Charge0
Average Mass284.352
Monoisotopic Mass284.16237
SMILES[H][C@]12O[C@@H](O)[C@H](C)[C@]3([H])CC[C@@H](C)[C@]4([H])CC[C@@](C)(OO[C@]143)O2
InChIInChI=1S/C15H24O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-13,16H,4-7H2,1-3H3/t8-,9-,10+,11+,12-,13-,14-,15-/m1/s1
InChIKeyBJDCWCLMFKKGEE-KDTBHNEXSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Chemical Role:
oxidising agent  A substance that removes electrons from another reactant in a redox reaction.
ChEBI Ontology
Outgoing Relation(s)
Dihydroartemisinin (DHA) (CHEBI:168754) is a artemisinin derivative (CHEBI:63920)
IUPAC Name 
(1R,4S,5R,8S,9R,10R,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-ol
Manual XrefsDatabases
9533004ChemSpider
Registry NumbersSources
CAS:81496-81-3ChemIDplus