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CHEBI:223734 - Cytosporacin

ChEBI IDCHEBI:223734
ChEBI NameCytosporacin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H28O11
Net Charge0
Average Mass564.543
Monoisotopic Mass564.16316
SMILESC=C1OC(=O)c2c(cc3c(c2O)C(O)=CC(=O)C3=C2C(=O)O[C@H](CCCCCCC)c3c2cc(O)c(O)c3O)[C@H]1O
InChIInChI=1S/C30H28O11/c1-3-4-5-6-7-8-19-22-14(10-18(33)26(35)28(22)37)23(29(38)41-19)20-13-9-15-24(30(39)40-12(2)25(15)34)27(36)21(13)17(32)11-16(20)31/h9-11,19,25,32-37H,2-8H2,1H3/t19-,25+/m1/s1
InChIKeyLWFDDAXTZRKOQW-CLOONOSVSA-N
Species of MetaboliteComponentSourceComments
Cytospora rhizophorae (ncbitaxon:407039) - PubMed (12895035)
ChEBI Ontology
Outgoing Relation(s)
Cytosporacin (CHEBI:223734) is a organic heterotricyclic compound (CHEBI:26979)
Cytosporacin (CHEBI:223734) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(4R)-6-[(1R)-1-heptyl-6,7,8-trihydroxy-3-oxo-1H-isochromen-4-ylidene]-4,9,10-trihydroxy-3-methylidene-4H-benzo[g]isochromene-1,7-dione