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Substance Name: Isoligustroside
RN: 108789-18-0
InChIKey: UFOVAZLPOLBVGA-MVVLSVRYSA-N

Molecular Formula

  • C25-H32-O12

Molecular Weight

  • 524.516
 
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Names and Synonyms

Results Name

  • Isoligustroside

Synonym

  • Isoligustroside

Systematic Name

  • 2H-Pyran-4-acetic acid, 3-ethylidene-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-5-((2-(4-hydroxyphenyl)ethoxy)carbonyl)-, methyl ester, (2S-(2alpha,3E,4beta))-

Registry Numbers

CAS Registry Number

  • 108789-18-0

System Generated Number

  • 0108789180

Structure Descriptors

InChI

1S/C25H32O12/c1-3-15-16(10-19(28)33-2)17(23(32)34-9-8-13-4-6-14(27)7-5-13)12-35-24(15)37-25-22(31)21(30)20(29)18(11-26)36-25/h3-7,12,16,18,20-22,24-27,29-31H,8-11H2,1-2H3/b15-3+/t16-,18+,20+,21-,22+,24-,25-/m0/s1

InChIKey

UFOVAZLPOLBVGA-MVVLSVRYSA-N

Smiles

C1(\[C@@H](OC=C([C@H]1CC(=O)OC)C(=O)OCCc1ccc(cc1)O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)=C\C