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CHEBI:216751 - Manginoid F

Default Structure
ChEBI IDCHEBI:216751
ChEBI NameManginoid F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H22O6
Net Charge0
Average Mass322.357
Monoisotopic Mass322.14164
SMILESC[C@]1(O)CC[C@H]2[C@]3(C)C[C@]45C[C@@]21O[C@@]4(O3)[C@]1(O)CO[C@@H](C1)C5=O
InChIInChI=1S/C17H22O6/c1-12-6-14-7-16(10(12)3-4-13(16,2)19)23-17(14,22-12)15(20)5-9(11(14)18)21-8-15/h9-10,19-20H,3-8H2,1-2H3/t9-,10-,12-,13-,14+,15+,16+,17+/m0/s1
InChIKeyYAHTYSQPIJMYGU-RPCSCJEJSA-N
Species of MetaboliteComponentSourceComments
Phyllosticta capitalensis (ncbitaxon:121624) - PubMed (29039958)
ChEBI Ontology
Outgoing Relation(s)
Manginoid F (CHEBI:216751) is a furofuran (CHEBI:47790)
IUPAC Name 
(1R,2R,5S,7R,9R,10S,13S,14S)-2,10-dihydroxy-10,14-dimethyl-4,15,16-trioxahexacyclo[7.6.1.12,5.17,14.01,7.09,13]octadecan-6-one
Manual XrefsDatabases
78439337ChemSpider