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Substance Name: Alepposide A
RN: 146714-05-8
InChIKey: GTJDJJFKPBGWBK-UHFFFAOYSA-N

Note

  • Isolated from Adonis aleppica.

Molecular Weight

  • 1115.26
 
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Names and Synonyms

Name of Substance

  • Alepposide A

Synonyms

  • Alepposide-A
  • Strophanthidin-3-O-beta-glucopyranosyl-(1-4)-O-beta-diginopyranosyl-(1-4)-O-beta-oleandropyranosyl-(1-4)-O-beta-digitoxopyranosyl-(1-4)-O-beta-digitoxopyranoside

Systematic Name

  • Card-20(22)-enolide, 3-((O-beta-D-glucopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-beta-D-lyxo-hexopyranosyl-(1-4)-O-2,6-dideoxy-3-O-methyl-beta-D-arabino-hexopyranosyl-(1-4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-5,14-dihydroxy-1 9-oxo-, (3beta,5beta)-

Registry Numbers

CAS Registry Number

  • 146714-05-8

System Generated Number

  • 0146714058

Structure Descriptors

InChI

1S/C55H86O23/c1-24-46(34(58)18-39(69-24)73-30-10-14-54(23-57)29(17-30)8-9-33-32(54)11-13-53(5)31(12-15-55(33,53)65)28-16-38(60)68-22-28)75-40-19-35(59)47(25(2)70-40)76-41-20-36(66-6)48(26(3)71-41)77-52-45(64)50(67-7)49(27(4)72-52)78-51-44(63)43(62)42(61)37(21-56)74-51/h16,23-27,29-37,39-52,56,58-59,61-65H,8-15,17-22H2,1-7H3

InChIKey

GTJDJJFKPBGWBK-UHFFFAOYSA-N

Smiles

O1[C@@H]([C@@H]([C@@H](O)[C@@H](O)[C@@H]1O[C@@H]1[C@@H](C)O[C@@H]([C@@H](O)[C@@H]1OC)O[C@@H]1[C@@H](O[C@@H](C[C@@H]1OC)O[C@@H]1[C@@H](C)O[C@@H](O[C@@H]2[C@@H](O[C@@H](C[C@@H]2O)O[C@@H]2CC[C@@]3([C@@H]4CC[C@@]5([C@@H](CC[C@@]5([C@@H]4CC[C@@H]3C2)O)C2=CC(OC2)=O)C)C=O)C)C[C@@H]1O)C)O)CO