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Substance Name: Apoptolidin
RN: 194874-06-1
UNII: SAO6WVQ23I
InChIKey: WILMROCKORZEMQ-AIUMZUNXSA-N

Note

  • An apoptosis inducer in transformed cells from Nocardiopsis sp.

Molecular Formula

  • C58-H96-O21

Molecular Weight

  • 1129.3754
 
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Names and Synonyms

Name of Substance

  • Apoptolidin

Synonyms

  • Apoptolidin
  • Apoptolidin A
  • FU-40A
  • UNII-SAO6WVQ23I

Registry Numbers

CAS Registry Number

  • 194874-06-1

FDA UNII

  • SAO6WVQ23I

System Generated Number

  • 0194874061

Structure Descriptors

InChI

1S/C58H96O21/c1-29-17-16-18-40(59)43(69-13)25-45(76-55(65)33(5)23-31(3)21-30(2)22-32(4)41(20-19-29)77-56-51(63)50(62)52(71-15)37(9)74-56)53(64)58(67)35(7)48(60)34(6)42(79-58)24-39(28-68-12)75-47-27-57(11,66)54(38(10)73-47)78-46-26-44(70-14)49(61)36(8)72-46/h17,19-23,32,34-54,56,59-64,66-67H,16,18,24-28H2,1-15H3/b20-19+,29-17+,30-22+,31-21+,33-23+/t32-,34+,35-,36-,37+,38+,39-,40+,41-,42-,43+,44-,45+,46+,47+,48+,49-,50+,51+,52+,53-,54+,56+,57+,58-/m1/s1

InChIKey

WILMROCKORZEMQ-AIUMZUNXSA-N

Smiles

C[C@@H]1/C=C(/C=C(/C=C(/C(=O)O[C@@H](C[C@@H]([C@H](CC/C=C(/C=C/[C@H]1O[C@H]2[C@H]([C@@H]([C@H]([C@@H](O2)C)OC)O)O)\C)O)OC)[C@H]([C@]3([C@@H]([C@H]([C@H]([C@H](O3)C[C@H](COC)O[C@H]4C[C@]([C@H]([C@@H](O4)C)O[C@H]5C[C@H]([C@@H]([C@H](O5)C)O)OC)(C)O)C)O)C)O)O)\C)\C)\C