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CHEBI:211077 - Gilluone A

ChEBI IDCHEBI:211077
ChEBI NameGilluone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H30O8
Net Charge0
Average Mass434.485
Monoisotopic Mass434.19407
SMILESCC[C@@H](C)[C@@]12O[C@]3(C)O[C@@]4(C)[C@]5(O)C(C)=C(OC)[C@@H]([C@]16C(OC)=C(C)C(=O)[C@@]356)[C@@]4(O)O2
InChIInChI=1S/C23H30O8/c1-9-10(2)23-19-14-13(27-7)12(4)21(25)17(5,22(14,26)31-23)29-18(6,30-23)20(19,21)15(24)11(3)16(19)28-8/h10,14,25-26H,9H2,1-8H3/t10-,14+,17+,18+,19-,20+,21-,22-,23+/m1/s1
InChIKeyRQSOOUUGQYQHAI-KJEJRYAGSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1039/c9qo00351g)
ChEBI Ontology
Outgoing Relation(s)
Gilluone A (CHEBI:211077) is a furofuran (CHEBI:47790)
IUPAC Name 
(1R,3R,4R,7S,8S,10S,11S,15S)-1-[(2R)-butan-2-yl]-3,7-dihydroxy-5,14-dimethoxy-6,8,10,13-tetramethyl-2,9,16-trioxahexacyclo[8.5.1.03,8.04,15.07,11.011,15]hexadeca-5,13-dien-12-one
Manual XrefsDatabases
77089211ChemSpider