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Concept information

... > organooxygen compound > oxacycle > dibenzopyran > xanthenes > xanthones > 1,5,8-trihydroxy-9-oxo-9h-xanthen-3-yl beta-d-glucopyranoside
... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > xanthones > 1,5,8-trihydroxy-9-oxo-9h-xanthen-3-yl beta-d-glucopyranoside
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > xanthones > 1,5,8-trihydroxy-9-oxo-9h-xanthen-3-yl beta-d-glucopyranoside

Preferred term

1,5,8-trihydroxy-9-oxo-9h-xanthen-3-yl beta-d-glucopyranoside  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C19H18O11

inchi

  • InChI=1S/C19H18O11/c20-5-11-14(24)16(26)17(27)19(30-11)28-6-3-9(23)12-10(4-6)29-18-8(22)2-1-7(21)13(18)15(12)25/h1-4,11,14,16-17,19-24,26-27H,5H2/t11-,14-,16+,17-,19-/m1/s1

inchikey

  • IOJCAEBIAPRCCI-FJMCMGCSSA-N

mass

  • 422.342

monoisotopicmass

  • 422.08491

smiles

  • O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC=2C=C3OC=4C(C(=O)C3=C(O)C2)=C(O)C=CC4O)CO

subset

  • 2_STAR

synonym EXACT

  • 1,5,8-trihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:183359

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