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CHEBI:204850 - Umbilicaxanthoside A

ChEBI IDCHEBI:204850
ChEBI NameUmbilicaxanthoside A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H28O11
Net Charge0
Average Mass504.488
Monoisotopic Mass504.16316
SMILESCOc1cc(CC=C(C)C)c(O)c2c(=O)c3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)c3oc12
InChIInChI=1S/C25H28O11/c1-10(2)4-5-11-6-15(33-3)24-17(18(11)28)19(29)13-7-12(8-14(27)23(13)36-24)34-25-22(32)21(31)20(30)16(9-26)35-25/h4,6-8,16,20-22,25-28,30-32H,5,9H2,1-3H3/t16-,20-,21+,22-,25-/m1/s1
InChIKeyFQFZNUKTSCMCQZ-RSLGMCBOSA-N
Species of MetaboliteComponentSourceComments
Umbilicaria proboscidea (ncbitaxon:232780) - DOI (10.1016/s0031-9422(02)00539-3)
ChEBI Ontology
Outgoing Relation(s)
Umbilicaxanthoside A (CHEBI:204850) is a xanthones (CHEBI:51149)
IUPAC Name 
1,5-dihydroxy-4-methoxy-2-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one
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