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CHEBI:205167 - Patientoside B

ChEBI IDCHEBI:205167
ChEBI NamePatientoside B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H24O10
Net Charge0
Average Mass448.424
Monoisotopic Mass448.13695
SMILESCOc1cc(O)c2c(c1)[C@@](O)([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1cc(C)cc(O)c1C2=O
InChIInChI=1S/C22H24O10/c1-8-3-10-15(12(24)4-8)18(27)16-11(5-9(31-2)6-13(16)25)22(10,30)21-20(29)19(28)17(26)14(7-23)32-21/h3-6,14,17,19-21,23-26,28-30H,7H2,1-2H3/t14-,17-,19+,20-,21-,22-/m1/s1
InChIKeyYRIBLYNKVATTRE-XFLFZXHGSA-N
Species of MetaboliteComponentSourceComments
Aspergillus fumigatus (ncbitaxon:746128) - PubMed (23683594)
ChEBI Ontology
Outgoing Relation(s)
Patientoside B (CHEBI:205167) is a anthracenes (CHEBI:46955)
IUPAC Name 
(10R)-1,8,10-trihydroxy-3-methoxy-6-methyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracen-9-one
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30814339ChemSpider