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Substance Name: Tyledoside D
RN: 102694-26-8
InChIKey: BKVAXXAKDQXAAJ-UHFFFAOYSA-N

Note

  • A cumulative neurotoxic bufadienolide, isolated from Tylecodon ventricosus.

Molecular Weight

  • 588.646
 
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Names and Synonyms

  • Tyledoside D

Registry Numbers

CAS Registry Number

  • 102694-26-8

System Generated Number

  • 0102694268

Structure Descriptors

InChI

1S/C31H40O11/c1-14-11-29(37-4)25(35)26(39-14)40-18-9-16-10-20-31(42-20)23(27(16,2)12-19(18)41-29)22(33)24(34)28(3)17(7-8-30(28,31)36)15-5-6-21(32)38-13-15/h5-6,13-14,16-20,22-23,25-26,33,35-36H,7-12H2,1-4H3

InChIKey

BKVAXXAKDQXAAJ-UHFFFAOYSA-N

Smiles

C1([C@@H]([C@@H]2[C@@]3(C[C@@H]4[C@@H](C[C@@H]3C[C@@H]3[C@@]2([C@@]2(O)[C@@]1([C@@H](CC2)c1ccc(oc1)=O)C)O3)O[C@@H]1O[C@@H](C)C[C@@]([C@@H]1O)(OC)O4)C)O)=O