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CHEBI:221841 - Anteaglonialide A

ChEBI IDCHEBI:221841
ChEBI NameAnteaglonialide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O6
Net Charge0
Average Mass356.374
Monoisotopic Mass356.12599
SMILESO=C1C[C@H](O)[C@H]([C@@H]2C[C@H](O)CCC23Oc2cccc4cccc(c24)O3)O1
InChIInChI=1S/C20H20O6/c21-12-7-8-20(13(9-12)19-14(22)10-17(23)24-19)25-15-5-1-3-11-4-2-6-16(26-20)18(11)15/h1-6,12-14,19,21-22H,7-10H2/t12-,13+,14+,19+/m1/s1
InChIKeyJGGAIMHFJGEJKE-BZIRYSOJSA-N
Species of MetaboliteComponentSourceComments
Anteaglonium (ncbitaxon:714361) - PubMed (26539727)
ChEBI Ontology
Outgoing Relation(s)
Anteaglonialide A (CHEBI:221841) is a naphthalenes (CHEBI:25477)
IUPAC Name 
(4S,5S)-4-hydroxy-5-[(1'S,5'R)-5'-hydroxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,2'-cyclohexane]-1'-yl]oxolan-2-one
Manual XrefsDatabases
78442729ChemSpider