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Substance Name: Molephantin
RN: 50656-66-1
InChIKey: LXINRHXYVUTAMQ-UESFRTJTSA-N

Note

  • Germacranolide from Elephantopus mollis.

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C19-H22-O6

Molecular Weight

  • 346.377
 
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Names and Synonyms

Name of Substance

  • Molephantin

Synonyms

  • 5-18-04-00355 (Beilstein Handbook Reference)
  • BRN 1329450
  • Molephantin

Systematic Name

  • 2-Propenoic acid, 2-methyl-, 2,3,3a,4,5,8,11,11a-octahydro-11-hydroxy-6,10-dimethyl-3-methylene-2,8-dioxocyclodeca(b)furan-4-yl ester, (3aR-(3aR*,4S*,6E,9Z,11S*,11aS*))-

Registry Numbers

CAS Registry Number

  • 50656-66-1

System Generated Number

  • 0050656661

Structure Descriptors

InChI

1S/C19H22O6/c1-9(2)18(22)24-14-7-10(3)6-13(20)8-11(4)16(21)17-15(14)12(5)19(23)25-17/h6,8,14-17,21H,1,5,7H2,2-4H3/b10-6-,11-8-/t14-,15+,16-,17-/m0/s1

InChIKey

LXINRHXYVUTAMQ-UESFRTJTSA-N

Smiles

C(C(=C)C)(=O)O[C@H]1CC(=CC(C=C([C@@H]([C@H]2OC(C([C@H]12)=C)=O)O)C)=O)C