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Substance Name: Acantholide
RN: 72548-16-4
InChIKey: MWYCMNPDBWRCKB-VRPNJRMNSA-N

Note

  • Sesquiterpene lactone from Acanthospermum glabratum.

Molecular Weight

  • 348.393
 
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Names and Synonyms

Name of Substance

  • Acantholide

Synonym

  • NSC 277282

Systematic Name

  • Propanoic acid, 2-methyl-, 6-formyl-2,3,3a,4,5,8,9,11a-octahydro-4-hydroxy-10-methyl-3-methylene-2-oxocyclodeca(b)furan-5-yl ester, (3aR-(3aR*,4S*,5S*,6E,10E,11aR*))-

Registry Numbers

CAS Registry Number

  • 72548-16-4

System Generated Number

  • 0072548164

Structure Descriptors

InChI

1S/C19H24O6/c1-10(2)18(22)25-17-13(9-20)7-5-6-11(3)8-14-15(16(17)21)12(4)19(23)24-14/h7-10,14-17,21H,4-6H2,1-3H3/b11-8-,13-7-/t14-,15+,16+,17+/m1/s1

InChIKey

MWYCMNPDBWRCKB-VRPNJRMNSA-N

Smiles

C(C(C)C)(=O)O[C@@H]1[C@H]([C@@H]2[C@H](OC(C2=C)=O)C=C(CCC=C1C=O)C)O