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Substance Name: Allamcin
RN: 93452-23-4
InChIKey: DWWKELQVGKIHDR-UQCOIBPSSA-N

Note

  • From bark of Plumeria rubra.

Molecular Formula

  • C13-H14-O5

Molecular Weight

  • 250.249
 
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Names and Synonyms

Name of Substance

  • Allamcin

Systematic Names

  • 2H,6H-1,4,5-Trioxadicyclopent(a,hi)inden-2-one, 3-ethylidene-3,3a,4a,7,7a,9b-hexahydro-6-hydroxy-, (3E,3aalpha,4abeta,6beta,7abeta,9aR*,9bbeta)-(+)-
  • 2H,6H-1,4,5-Trioxadicyclopenta(a,hi)inden-2-one, 3-ethylidene-3,3a,4a,7,7a,9b-hexahydro-6-hydroxy-, (3E,3aalpha,4abeta,6beta,7abeta,9aR*,9bbeta)-(+)-

Registry Numbers

CAS Registry Number

  • 93452-23-4

System Generated Number

  • 0093452234

Structure Descriptors

InChI

1S/C13H14O5/c1-2-7-10-13(18-11(7)15)4-3-6-5-8(14)16-12(17-10)9(6)13/h2-4,6,8-10,12,14H,5H2,1H3/b7-2-

InChIKey

DWWKELQVGKIHDR-UQCOIBPSSA-N

Smiles

C1(C(\[C@@H]2O[C@@H]3O[C@@H](C[C@@H]4C=C[C@@]2(O1)[C@@H]34)O)=C\C)=O