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Substance Name: Nigericin, (28S)-
RN: 108266-17-7
InChIKey: MLKLDZRMDWHDHH-BSKDZVIVSA-N

Molecular Formula

  • C40-H68-O11

Molecular Weight

  • 722.994
 
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Names and Synonyms

Synonym

  • Epinigericin

Systematic Name

  • Nigericin, (28S)-

Registry Numbers

CAS Registry Number

  • 108266-17-7

System Generated Number

  • 0108266177

Structure Descriptors

InChI

1S/C41H70O10/c1-22-12-13-30(46-35(22)27(6)29(8)43)18-31-19-32(45-11)28(7)41(48-31)26(5)20-39(10,51-41)34-14-15-38(9,49-34)37-24(3)17-33(47-37)36-23(2)16-25(4)40(44,21-42)50-36/h22-28,30-37,42,44H,12-21H2,1-11H3/t22-,23-,24-,25-,26+,27-,28+,30+,31+,32+,33+,34+,35+,36-,37+,38-,39-,40-,41?/m0/s1

InChIKey

MLKLDZRMDWHDHH-BSKDZVIVSA-N

Smiles

O1[C@@]2([C@@H]([C@H](OC)C[C@H](O2)C[C@@H]2O[C@@H]([C@H](C(=O)C)C)[C@H](CC2)C)C)[C@@H](C[C@@]1([C@@H]1O[C@@]([C@@H]2O[C@@H]([C@H]3O[C@@](O)(CO)[C@H](C[C@@H]3C)C)C[C@@H]2C)(C)CC1)C)C