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CHEBI:207330 - Palmarumycin C10

ChEBI IDCHEBI:207330
ChEBI NamePalmarumycin C10
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H12O7
Net Charge0
Average Mass364.309
Monoisotopic Mass364.05830
SMILESO=C1C=CC(=O)[C@@]23O[C@@]12C1(Oc2cccc4cccc(c24)O1)[C@@H]1O[C@@H]1[C@@H]3O
InChIInChI=1S/C20H12O7/c21-12-7-8-13(22)19-18(12,27-19)16(23)15-17(24-15)20(19)25-10-5-1-3-9-4-2-6-11(26-20)14(9)10/h1-8,15-17,23H/t15-,16+,17-,18+,19+/m1/s1
InChIKeyOSNKKJLNXMIUHW-LFDJNIOPSA-N
Species of MetaboliteComponentSourceComments
Coniothyriumspecies (ncbitaxon:1756115) - DOI (10.1002/jlac.199419941108)
ChEBI Ontology
Outgoing Relation(s)
Palmarumycin C10 (CHEBI:207330) is a naphthalenes (CHEBI:25477)
IUPAC Name 
(1'R,3'R,5'R,6'S,7'S)-6'-hydroxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,2'-4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodec-9-ene]-8',11'-dione