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Substance Name: Diphyllin acetyl apioside
RN: 111647-42-8
InChIKey: UOOSHUGMIURKRC-KXPDKNHFSA-N

Note

  • From the herb Haplophyllum hispanicum.

Molecular Formula

  • C28-H26-O12

Molecular Weight

  • 554.501
 
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Names and Synonyms

Name of Substance

  • Diphyllin acetyl apioside

Synonym

  • 4-O-(5''-O-Acetyl)-(beta-D-apiofuranosyl)-6,7-dimethoxy-1-(3',4'-methylenedioxyphenyl)-3-hydroxymethylnaphthalene-2-carboxylic acid lactone

Systematic Name

  • Naphtho(2,3-c)furan-1(3H)-one, 4-((5-O-acetyl-D-apio-beta-D-furanosyl)oxy)-9-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-

Registry Numbers

CAS Registry Number

  • 111647-42-8

System Generated Number

  • 0111647428

Structure Descriptors

InChI

1S/C28H26O12/c1-13(29)36-10-28(32)11-37-27(25(28)30)40-24-16-8-20(34-3)19(33-2)7-15(16)22(23-17(24)9-35-26(23)31)14-4-5-18-21(6-14)39-12-38-18/h4-8,25,27,30,32H,9-12H2,1-3H3/t25-,27?,28+/m0/s1

InChIKey

UOOSHUGMIURKRC-KXPDKNHFSA-N

Smiles

C1O[C@@H]([C@@H]([C@@]1(COC(C)=O)O)O)Oc1c2c(cc(c(c2)OC)OC)c(c2c1COC2=O)c1ccc2c(c1)OCO2