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CHEBI:212354 - Austalide N

ChEBI IDCHEBI:212354
ChEBI NameAustalide N
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SubmitterMetaboLights
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FormulaC28H36O10
Net Charge0
Average Mass532.586
Monoisotopic Mass532.23085
SMILESCOc1c2c(c(C)c3c1[C@@H](OC(C)=O)[C@H]1[C@](C)(C[C@@H](O)[C@]45O[C@](OC)(CC[C@]14C)OC5(C)C)O3)COC2=O
InChIInChI=1S/C28H36O10/c1-13-15-12-34-23(31)17(15)20(32-7)18-19(13)36-26(6)11-16(30)28-24(3,4)37-27(33-8,38-28)10-9-25(28,5)22(26)21(18)35-14(2)29/h16,21-22,30H,9-12H2,1-8H3/t16-,21-,22-,25-,26+,27+,28-/m1/s1
InChIKeyLAWHMUYVIUCKNM-NOJKAEQMSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies (ncbitaxon:5065) - PubMed (25855820)
ChEBI Ontology
Outgoing Relation(s)
Austalide N (CHEBI:212354) is a xanthenes (CHEBI:38835)
IUPAC Name 
[(1R,2R,4S,15S,16S,17R,20S)-2-hydroxy-13,20-dimethoxy-4,7,17,22,22-pentamethyl-11-oxo-5,10,21,23-tetraoxahexacyclo[18.2.1.01,17.04,16.06,14.08,12]tricosa-6(14),7,12-trien-15-yl] acetate
Manual XrefsDatabases
28185033ChemSpider