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Substance Name: Swertisin
RN: 6991-10-2
InChIKey: ABRULANJVVJLFI-DGHBBABESA-N

Note

  • From Wilbrandia ebracteata.

Molecular Formula

  • C22-H22-O10

Molecular Weight

  • 446.406
 
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Names and Synonyms

Results Name

  • Swertisin

Synonyms

  • NSC 641547
  • Swertisin

Systematic Name

  • 4H-Benzopyran-4-one, 6-beta-D-glucopyranosyl-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-

Registry Numbers

CAS Registry Number

  • 6991-10-2

System Generated Number

  • 0006991102

Structure Descriptors

InChI

1S/C22H22O10/c1-30-13-7-14-16(11(25)6-12(31-14)9-2-4-10(24)5-3-9)19(27)17(13)22-21(29)20(28)18(26)15(8-23)32-22/h2-7,15,18,20-24,26-29H,8H2,1H3/t15-,18-,20+,21-,22+/m1/s1

InChIKey

ABRULANJVVJLFI-DGHBBABESA-N

Smiles

c1([C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)c(c2c(cc(oc2cc1OC)c1ccc(cc1)O)=O)O