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CHEBI:219189 - Aszonapyrone A

ChEBI IDCHEBI:219189
ChEBI NameAszonapyrone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H40O5
Net Charge0
Average Mass456.623
Monoisotopic Mass456.28757
SMILESC=C1CC[C@H]2[C@@](C)(CC[C@H]3C(C)(C)[C@@H](OC(C)=O)CC[C@]23C)[C@@H]1Cc1c(O)cc(C)oc1=O
InChIInChI=1S/C28H40O5/c1-16-8-9-23-27(6,20(16)15-19-21(30)14-17(2)32-25(19)31)12-10-22-26(4,5)24(33-18(3)29)11-13-28(22,23)7/h14,20,22-24,30H,1,8-13,15H2,2-7H3/t20-,22+,23+,24+,27+,28+/m1/s1
InChIKeyQZWJQNIIRYNONX-NEKODSHDSA-N
Species of MetaboliteComponentSourceComments
Penicilliopsis zonata (ncbitaxon:41063) - DOI (10.1080/00021369.1982.10865366)
ChEBI Ontology
Outgoing Relation(s)
Aszonapyrone A (CHEBI:219189) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
[(2S,4aR,4bS,8R,8aS,10aR)-8-[(4-hydroxy-6-methyl-2-oxopyran-3-yl)methyl]-1,1,4a,8a-tetramethyl-7-methylidene-2,3,4,4b,5,6,8,9,10,10a-decahydrophenanthren-2-yl] acetate
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30771089ChemSpider