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CHEBI:201068 - Microluside A

ChEBI IDCHEBI:201068
ChEBI NameMicroluside A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC45H46O23
Net Charge0
Average Mass954.840
Monoisotopic Mass954.24299
SMILESO=C(O[C@@H]1[C@@H](O)[C@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](Oc3cccc4c(=O)c5cccc(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6OC(=O)c6ccc(O)cc6)c5oc34)O[C@H]2CO)O[C@H]1CO)c1ccc(O)cc1
InChIInChI=1S/C45H46O23/c46-15-26-30(52)31(53)40(67-42(59)19-9-13-21(50)14-10-19)45(62-26)61-25-6-2-4-23-29(51)22-3-1-5-24(36(22)65-37(23)25)60-43-34(56)33(55)39(28(17-48)63-43)68-44-35(57)32(54)38(27(16-47)64-44)66-41(58)18-7-11-20(49)12-8-18/h1-14,26-28,30-35,38-40,43-50,52-57H,15-17H2/t26-,27+,28+,30-,31+,32+,33+,34+,35+,38+,39+,40-,43+,44-,45-/m1/s1
InChIKeyBGZRIXRLEGZUKI-LNHZTKDKSA-N
Species of MetaboliteComponentSourceComments
Micrococcusspecies EG45 (ncbitaxon:909621) - PubMed (25283555)
ChEBI Ontology
Outgoing Relation(s)
Microluside A (CHEBI:201068) is a xanthones (CHEBI:51149)
IUPAC Name 
[(2S,3R,4S,5S,6R)-6-[(2S,3R,4S,5S,6R)-6-[5-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-(4-hydroxybenzoyl)oxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-oxoxanthen-4-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] 4-hydroxybenzoate
Manual XrefsDatabases
78440097ChemSpider