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Concept information

... > organooxygen compound > oxacycle > dibenzopyran > xanthenes > xanthones > 15-chlorotajixanthone hydrate
... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > xanthones > 15-chlorotajixanthone hydrate

Preferred term

15-chlorotajixanthone hydrate  

Type

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

Broader concept

charge

  • 0

formula

  • C25H27ClO6

inchi

  • InChI=1S/C25H27ClO6/c1-11(2)14-10-31-23-12(3)8-16-19(20(23)21(14)28)22(29)18-15(27)7-6-13(24(18)32-16)9-17(26)25(4,5)30/h6-8,14,17,21,27-28,30H,1,9-10H2,2-5H3/t14-,17+,21-/m1/s1

inchikey

  • DQHHJZQNNVLSOI-DAESXHAQSA-N

mass

  • 458.940

monoisotopicmass

  • 458.14962

smiles

  • Cl[C@H](C(O)(C)C)CC1=C2OC3=C(C4=C(OC[C@@H]([C@H]4O)C(=C)C)C(=C3)C)C(C2=C(O)C=C1)=O

subset

  • 2_STAR

synonym EXACT

  • (1R,2S)-8-[(2S)-2-chloro-3-hydroxy-3-methylbutyl]-1,11-dihydroxy-5-methyl-2-prop-1-en-2-yl-2,3-dihydro-1H-pyrano[3,2-a]xanthen-12-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217620

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