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Substance Name: Isoamericanin A
RN: 69506-79-2
InChIKey: NTXXGPYGMQQSML-OWOJBTEDSA-N

Note

  • Isolated from the seeds of Phytolacca americana.

Molecular Formula

  • C18-H16-O6

Molecular Weight

  • 328.318
 
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Names and Synonyms

Name of Substance

  • Isoamericanin A

Systematic Name

  • 2-Propenal, 3-(2-(3,4-dihydroxyphenyl)-2,3-dihydro-3-(hydroxymethyl)-1,4-benzodioxin-6-yl)-

Registry Numbers

CAS Registry Number

  • 69506-79-2

System Generated Number

  • 0069506792

Structure Descriptors

InChI

1S/C18H16O6/c19-7-1-2-11-3-6-15-16(8-11)23-17(10-20)18(24-15)12-4-5-13(21)14(22)9-12/h1-9,17-18,20-22H,10H2/b2-1+

InChIKey

NTXXGPYGMQQSML-OWOJBTEDSA-N

Smiles

C(\C=C\c1cc2O[C@@H]([C@@H](Oc2cc1)c1cc(c(cc1)O)O)CO)=O