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CHEBI:203646 - Palmarumycin B5

ChEBI IDCHEBI:203646
ChEBI NamePalmarumycin B5
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O8
Net Charge0
Average Mass386.356
Monoisotopic Mass386.10017
SMILESO=C1C[C@H](O)[C@H](O)C2=C[C@H](O)[C@@H](O)C3(Oc4cccc5cccc(c45)O3)[C@]12O
InChIInChI=1S/C20H18O8/c21-11-8-15(23)19(26)10(17(11)24)7-12(22)18(25)20(19)27-13-5-1-3-9-4-2-6-14(28-20)16(9)13/h1-7,11-12,17-18,21-22,24-26H,8H2/t11-,12-,17+,18+,19+/m0/s1
InChIKeyQUYXDKPCDHWNLZ-OHUKFJGISA-N
Species of MetaboliteComponentSourceComments
Berkleasmiumspecies (ncbitaxon:1950114) - PubMed (25237727)
ChEBI Ontology
Outgoing Relation(s)
Palmarumycin B5 (CHEBI:203646) is a naphthalenes (CHEBI:25477)
IUPAC Name 
(3'S,4'R,6'S,7'R,8'aR)-3',4',6',7',8'a-pentahydroxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,8'-3,4,6,7-tetrahydro-2H-naphthalene]-1'-one
Manual XrefsDatabases
58121558ChemSpider