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Substance Name: Deacetyleupaserrin
RN: 38456-39-2
InChIKey: JZJVLLYTTWUPBF-NQIXEDOISA-N

Note

  • Antileukemic sesquiterpene lactone from Eupatorium semiserratum.

Molecular Formula

  • C20-H26-O6

Molecular Weight

  • 362.4194
 
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Names and Synonyms

Name of Substance

  • Deacetyleupaserrin

Systematic Names

  • 2-Butenoic acid, 2-(hydroxymethyl)-, 2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-octacyclodeca(b)furan-4-yl ester, (3aR-(3aR*,4R*(Z),6E,8S*,10E,11aR*))-
  • 2-Butenoic acid, 2-(hydroxymethyl)-, 2,3,3a,4,5,8,9,11a-octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca(b)furan-4-yl ester, (3aR-(3aR*,4R*(Z),6E,8S*,10E,11aR*))-

Registry Numbers

CAS Registry Number

  • 38456-39-2

System Generated Number

  • 0038456392

Structure Descriptors

InChI

1S/C20H26O6/c1-5-14(10-21)20(24)26-17-9-12(3)7-15(22)6-11(2)8-16-18(17)13(4)19(23)25-16/h5,7-8,15-18,21-22H,4,6,9-10H2,1-3H3/b11-8-,12-7-,14-5+/t15-,16+,17+,18-/m0/s1

InChIKey

JZJVLLYTTWUPBF-NQIXEDOISA-N

Smiles

C1(=O)C(=C)[C@H]2[C@H](O1)C=C(C[C@@H](C=C(C[C@H]2OC(=O)/C(=C/C)CO)C)O)C