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CHEBI:69698 - Pestalospirane A

ChEBI IDCHEBI:69698
ChEBI NamePestalospirane A
Stars
DefinitionA natural product found in Pestalotiopsis virgatula.
Last Modified22 September 2014
DownloadsMolfile
FormulaC24H24O6
Net Charge0
Average Mass408.450
Monoisotopic Mass408.15729
SMILESC[C@H]1O[C@]2(C=Cc3cccc(O)c3CO2)[C@@H](C)O[C@@]12C=Cc1cccc(O)c1CO2
InChIInChI=1S/C24H24O6/c1-15-23(11-9-17-5-3-7-21(25)19(17)13-27-23)30-16(2)24(29-15)12-10-18-6-4-8-22(26)20(18)14-28-24/h3-12,15-16,25-26H,13-14H2,1-2H3/t15-,16-,23-,24+/m1/s1
InChIKeyGWADQOOKXMSEMY-TVKIDPOGSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis virgatula (ncbitaxon:290289) mycelium (BTO:0001436) PubMed (21942847) Endophytic fungus derived from the plant Terminalia chebula.
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)
Pestalospirane A (CHEBI:69698) has role metabolite (CHEBI:25212)
Pestalospirane A (CHEBI:69698) is a phenols (CHEBI:33853)
Citations