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Substance Name: Dethiophalloidin
RN: 35173-40-1
InChIKey: IYJPKTWFAHJIAW-UHFFFAOYSA-N

Molecular Formula

  • C35-H50-N8-O11

Molecular Weight

  • 758.825
 
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Names and Synonyms

Name of Substance

  • Dethiophalloidin

Systematic Name

  • Phalloidin, 3-L-alanine-6-L-tryptophan-

Registry Numbers

CAS Registry Number

  • 35173-40-1

System Generated Number

  • 0035173401

Structure Descriptors

InChI

1S/C35H50N8O11/c1-16-28(47)40-24(10-20-13-36-23-9-7-6-8-22(20)23)30(49)41-25(12-35(5,54)15-44)31(50)37-17(2)29(48)42-27(19(4)45)33(52)39-18(3)34(53)43-14-21(46)11-26(43)32(51)38-16/h6-9,13,16-19,21,24-27,36,44-46,54H,10-12,14-15H2,1-5H3,(H,37,50)(H,38,51)(H,39,52)(H,40,47)(H,41,49)(H,42,48)

InChIKey

IYJPKTWFAHJIAW-UHFFFAOYSA-N

Smiles

[nH]1c2c(c(C[C@@H]3NC([C@@H](NC(=O)[C@@H]4C[C@@H](O)CN4C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC([C@@H](C[C@@](CO)(O)C)NC3=O)=O)C)[C@@H](C)O)C)C)=O)c1)cccc2