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CHEBI:209824 - Pestalotheol O

ChEBI IDCHEBI:209824
ChEBI NamePestalotheol O
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H26O6
Net Charge0
Average Mass338.400
Monoisotopic Mass338.17294
SMILESC=C(C)C=C=C1C[C@@H]2O[C@@H](C(C)(C)O)C[C@@]2(O)[C@@H](OC(C)=O)[C@@H]1O
InChIInChI=1S/C18H26O6/c1-10(2)6-7-12-8-13-18(22,9-14(24-13)17(4,5)21)16(15(12)20)23-11(3)19/h6,13-16,20-22H,1,8-9H2,2-5H3/t7?,13-,14+,15+,16-,18-/m0/s1
InChIKeyUDGGWZAIZWVIEQ-UROALPJMSA-N
Species of MetaboliteComponentSourceComments
Pseudopestalotiopsis theae (ncbitaxon:218556) - PubMed (32102178)
ChEBI Ontology
Outgoing Relation(s)
Pestalotheol O (CHEBI:209824) is a benzofurans (CHEBI:35259)