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Substance Name: Toxin III (Helminthosporium carbonum)
RN: 106894-13-7
InChIKey: NZFQDHZWYOBUCF-UHFFFAOYSA-N

Molecular Formula

  • C21-H32-N4-O7

Molecular Weight

  • 452.505
 
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Names and Synonyms

Results Name

  • Toxin III (Helminthosporium carbonum)

Synonym

  • Toxin III (Helminthosporium carbonum)

Systematic Name

  • Cyclo(alanylalanyl-8-oxiranyl-8-oxo-2-aminooctanoyl-trans-3-hydroxyprolyl)

Registry Numbers

CAS Registry Number

  • 106894-13-7

System Generated Number

  • 0106894137

Structure Descriptors

InChI

1S/C21H32N4O7/c1-11-18(28)22-12(2)19(29)24-13(6-4-3-5-7-14(26)16-10-32-16)21(31)25-9-8-15(27)17(25)20(30)23-11/h11-13,15-17,27H,3-10H2,1-2H3,(H,22,28)(H,23,30)(H,24,29)

InChIKey

NZFQDHZWYOBUCF-UHFFFAOYSA-N

Smiles

N1C([C@@H](NC([C@@H]2N(C([C@@H](CCCCCC([C@@H]3OC3)=O)NC([C@@H]1C)=O)=O)CC[C@@H]2O)=O)C)=O