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Substance Name: Neooleuropein
RN: 108789-16-8
InChIKey: JIMGXIXILGGGKF-CNXMPEIMSA-N

Molecular Formula

  • C32-H38-O15

Molecular Weight

  • 662.637
 
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Names and Synonyms

Results Name

  • Neooleuropein

Synonyms

  • Jasmultiside
  • Neooleuropein

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 108789-16-8

System Generated Number

  • 0108789168

Structure Descriptors

InChI

1S/C32H38O15/c1-2-18-19(13-26(38)43-9-7-16-3-5-21(34)23(36)11-16)20(30(42)44-10-8-17-4-6-22(35)24(37)12-17)15-45-31(18)47-32-29(41)28(40)27(39)25(14-33)46-32/h2-6,11-12,15,19,25,27-29,31-37,39-41H,7-10,13-14H2,1H3/b18-2+/t19-,25+,27+,28-,29+,31-,32-/m0/s1

InChIKey

JIMGXIXILGGGKF-CNXMPEIMSA-N

Smiles

C1(\[C@@H](OC=C([C@H]1CC(=O)OCCc1cc(c(cc1)O)O)C(=O)OCCc1cc(c(cc1)O)O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)=C\C