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Substance Name: Bonafousioside
RN: 115900-10-2
InChIKey: WODHEHKVGYDCOS-ZNPNLSIGSA-N

Note

  • From the dried bark of Bonafousia macrocalyx

Molecular Formula

  • C28-H40-O13

Molecular Weight

  • 584.611
 
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Names and Synonyms

Results Name

  • Bonafousioside

Synonym

  • Bonafousioside

Systematic Name

  • beta-D-Glucopyranoside, 4-(3,4-dihydroxy-5-methoxyphenyl)-2-((4-hydroxy-3,5-dimethoxyphenyl)methyl)-3-(methoxymethyl)butyl, (R-(R*,R*))-

Registry Numbers

CAS Registry Number

  • 115900-10-2

System Generated Number

  • 0115900102

Structure Descriptors

InChI

1S/C28H40O13/c1-6-7-8-40-25-26(33,13-16-9-19(37-3)24(32)20(10-16)38-4)27(34,15-36-2)28(35,22(14-29)41-25)17-11-18(30)23(31)21(12-17)39-5/h9-12,22,25,29-35H,6-8,13-15H2,1-5H3/t22-,25-,26+,27+,28-/m1/s1

InChIKey

WODHEHKVGYDCOS-ZNPNLSIGSA-N

Smiles

O([C@H]1[C@](O)([C@](O)([C@](O)([C@H](O1)CO)c1cc(c(c(c1)OC)O)O)COC)Cc1cc(c(c(c1)OC)O)OC)CCCC