EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:67665 - Xerophilusin N

ChEBI IDCHEBI:67665
ChEBI NameXerophilusin N
Stars
DefinitionA natural product found in Isodon adenolomus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H26O6
Net Charge0
Average Mass362.422
Monoisotopic Mass362.17294
SMILES[H][C@@]12CC[C@]3([H])C(=C)C(=O)[C@@]1([C@@H]3O)[C@]1(O)OC(=O)[C@]23CCCC(C)(C)[C@@]3([H])[C@@H]1O
InChIInChI=1S/C20H26O6/c1-9-10-5-6-11-18-8-4-7-17(2,3)12(18)15(23)20(25,26-16(18)24)19(11,13(9)21)14(10)22/h10-12,14-15,22-23,25H,1,4-8H2,2-3H3/t10-,11+,12-,14-,15+,18-,19+,20-/m1/s1
InChIKeyCGLKYUSLUAHYRT-LTLNESCBSA-N
Species of MetaboliteComponentSourceComments
Isodon adenolomus (ncbitaxon:662903) aerial part (BTO:0001658) PubMed (21534539) 70% aqueous acetone extract of air-dried and powdered aerial parts
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Xerophilusin N (CHEBI:67665) has role metabolite (CHEBI:25212)
Xerophilusin N (CHEBI:67665) is a diterpene lactone (CHEBI:49193)
Manual XrefsDatabases
23311667ChemSpider
Citations