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Concept information

Preferred term

swertiajaponin  

Type

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

charge

  • 0

formula

  • C22H24O11

has_functional_parent

inchi

  • InChI=1S/C22H24O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,14-16,18,20-25,27-30H,7H2,1H3/t14?,15-,16?,18-,20+,21-,22+/m1/s1

inchikey

  • UMWNGGYPGAHOPP-IBKWXVHQSA-N

mass

  • 464.41940

monoisotopicmass

  • 464.13186

smiles

  • COC1=CC2OC(=CC(=O)C2C(O)=C1[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccc(O)c(O)c1

subset

  • 3_STAR

synonym EXACT

  • (1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-4-oxo-4a,8a-dihydro-4H-1-benzopyran-6-yl]-D-glucitol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:9369

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