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CHEBI:175564 - Austalide J

ChEBI IDCHEBI:175564
ChEBI NameAustalide J
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H32O7
Net Charge0
Average Mass444.524
Monoisotopic Mass444.21480
SMILES[H][C@]12Cc3c(c(C)c4c(c3OC)C(=O)OC4)O[C@@]1(C)CC[C@@]1(O)C(C)(C)OC(=O)CC[C@]21C
InChIInChI=1S/C25H32O7/c1-13-15-12-30-21(27)18(15)20(29-6)14-11-16-23(4)8-7-17(26)31-22(2,3)25(23,28)10-9-24(16,5)32-19(13)14/h16,28H,7-12H2,1-6H3/t16-,23-,24+,25-/m1/s1
InChIKeyGEOMINBWFXSCOW-OCFMFRIESA-N
ChEBI Ontology
Outgoing Relation(s)
Austalide J (CHEBI:175564) is a xanthenes (CHEBI:38835)
IUPAC Name 
(1S,13R,14R,20S)-20-hydroxy-10-methoxy-1,4,14,19,19-pentamethyl-2,7,18-trioxapentacyclo[11.9.0.03,11.05,9.014,20]docosa-3(11),4,9-triene-8,17-dione
Manual XrefsDatabases
139989ChemSpider
Registry NumbersSources
CAS:87833-51-0ChemIDplus