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Substance Name: Glucofrangulin A octaacetate
RN: 27830-51-9
UNII: 3B2L14ZJZN
InChIKey: MKELHOZHVOEMJW-DEVZOIBGSA-N

Molecular Weight

  • 914.8144
 
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Names and Synonyms

Name of Substance

  • Glucofrangulin A octaacetate

Synonyms

  • 9,10-Anthracenedione, 1-(acetyloxy)-3-methyl-8-((2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)oxy)-6-((2,3,4-tri-O-acetyl-6-deoxy-alpha-L-mannopyranosyl)oxy)-
  • Glucofrangulin A octaacetate
  • Glucofrangulin A octaacetate [MI]
  • Glucofrangulin A, octaacetate
  • UNII-3B2L14ZJZN

Registry Numbers

CAS Registry Number

  • 27830-51-9

FDA UNII

  • 3B2L14ZJZN

System Generated Number

  • 0027830519

Structure Descriptors

InChI

1S/C43H46O22/c1-16-11-27-32(29(12-16)56-19(4)45)35(53)33-28(34(27)52)13-26(63-42-40(61-24(9)50)38(59-22(7)48)36(17(2)55-42)57-20(5)46)14-30(33)64-43-41(62-25(10)51)39(60-23(8)49)37(58-21(6)47)31(65-43)15-54-18(3)44/h11-14,17,31,36-43H,15H2,1-10H3/t17-,31+,36-,37+,38+,39-,40+,41+,42-,43+/m0/s1

InChIKey

MKELHOZHVOEMJW-DEVZOIBGSA-N

Smiles

Cc1cc2c(c(c1)OC(=O)C)C(=O)c3c(cc(cc3O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC(=O)C)OC(=O)C)OC(=O)C)C2=O