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CHEBI:210315 - Aturanoside B

ChEBI IDCHEBI:210315
ChEBI NameAturanoside B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H24O9
Net Charge0
Average Mass444.436
Monoisotopic Mass444.14203
SMILESCCCc1cc(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc2c1C(=O)c1c(O)cc(O)cc1C2=O
InChIInChI=1S/C23H24O9/c1-3-4-10-5-12(32-23-22(30)21(29)18(26)9(2)31-23)8-14-16(10)20(28)17-13(19(14)27)6-11(24)7-15(17)25/h5-9,18,21-26,29-30H,3-4H2,1-2H3/t9-,18-,21+,22+,23-/m0/s1
InChIKeyGTPJGVVTKHDAKA-KTLGGQSLSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (30207722)
ChEBI Ontology
Outgoing Relation(s)
Aturanoside B (CHEBI:210315) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
1,3-dihydroxy-8-propyl-6-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyanthracene-9,10-dione
Manual XrefsDatabases
78439886ChemSpider