CHEBI:66472 - 10α-hydroperoxy-guaia-1,11-diene

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ChEBI Name 10α-hydroperoxy-guaia-1,11-diene
ChEBI ID CHEBI:66472
ChEBI ASCII Name 10alpha-hydroperoxy-guaia-1,11-diene
Definition A guaiane sesquiterpenoid that is guaia-1,11-diene substituted by a α-hydroperoxy group at position 10. Isolated from Pogostemon cablin, it exhibits trypanocidal activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C15H24O2
Net Charge 0
Average Mass 236.34990
Monoisotopic Mass 236.17763
InChI InChI=1S/C15H24O2/c1-10(2)12-7-8-15(4,17-16)14-6-5-11(3)13(14)9-12/h6,11-13,16H,1,5,7-9H2,2-4H3/t11-,12+,13-,15+/m0/s1
InChIKey WVEJIBNZNZLFEF-SFDCQRBFSA-N
SMILES [H][C@@]12C[C@@H](CC[C@@](C)(OO)C1=CC[C@@H]2C)C(C)=C
Metabolite of Species Details
Pogostemon cablin (NCBI:txid28511) Found in whole plant (BTO:0001461). See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
trypanocidal drug
A drug used to treat or prevent infections caused by protozoal organisms belonging to the suborder Trypanosomatida.
Application(s): trypanocidal drug
A drug used to treat or prevent infections caused by protozoal organisms belonging to the suborder Trypanosomatida.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 10α-hydroperoxy-guaia-1,11-diene (CHEBI:66472) has role metabolite (CHEBI:25212)
10α-hydroperoxy-guaia-1,11-diene (CHEBI:66472) has role trypanocidal drug (CHEBI:36335)
10α-hydroperoxy-guaia-1,11-diene (CHEBI:66472) is a guaiane sesquiterpenoid (CHEBI:36744)
10α-hydroperoxy-guaia-1,11-diene (CHEBI:66472) is a peroxol (CHEBI:35924)
IUPAC Name
(1S,4R,7R,8aS)-1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,4,5,6,7,8,8a-octahydroazulen-4-yl hydroperoxide
Registry Number Type Source
9925408 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
15577255 PubMed citation Europe PMC
Last Modified
03 July 2013