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CHEBI:216260 - Spirodalesol

ChEBI IDCHEBI:216260
ChEBI NameSpirodalesol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H18O8
Net Charge0
Average Mass518.477
Monoisotopic Mass518.10017
SMILESCOC(=O)C12C(=O)c3c(O)cccc3C1=C1C=CC(=O)c3c(O)ccc(c31)C21C=CC(=O)c2c(O)cccc21
InChIInChI=1S/C31H18O8/c1-39-29(38)31-27(14-4-2-6-18(32)24(14)28(31)37)15-8-10-20(34)26-21(35)11-9-17(23(15)26)30(31)13-12-22(36)25-16(30)5-3-7-19(25)33/h2-13,32-33,35H,1H3
InChIKeyMGLQXZJRIOSKCO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Daldinia eschscholtzii (ncbitaxon:292717) - PubMed (27978645)
ChEBI Ontology
Outgoing Relation(s)
Spirodalesol (CHEBI:216260) is a lignan (CHEBI:25036)
IUPAC Name 
methyl 5,7',15'-trihydroxy-4,9',17'-trioxospiro[naphthalene-1,11'-pentacyclo[10.7.1.02,10.03,8.016,20]icosa-1,3(8),4,6,12(20),13,15,18-octaene]-10'-carboxylate
Manual XrefsDatabases
78435388ChemSpider