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Substance Name: Trichothec-9-ene-3,4,7,15-tetrol, 12,13-epoxy-, 4,15-diacetate, (3alpha,4beta)-
RN: 54781-88-3
InChIKey: DXOMWDQITCLYBJ-AEOSVVKMSA-N

Molecular Weight

  • 382.406
 
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Names and Synonyms

  • Trichothec-9-ene-3,4,7,15-tetrol, 12,13-epoxy-, 4,15-diacetate, (3alpha,4beta)-

Registry Numbers

CAS Registry Number

  • 54781-88-3

System Generated Number

  • 0054781883

Structure Descriptors

InChI

1S/C19H26O8/c1-9-5-12(22)18(7-24-10(2)20)13(6-9)27-16-14(23)15(26-11(3)21)17(18,4)19(16)8-25-19/h6,12-16,22-23H,5,7-8H2,1-4H3/t12?,13-,14-,15-,16-,17-,18+,19?/m1/s1

InChIKey

DXOMWDQITCLYBJ-AEOSVVKMSA-N

Smiles

C[C@@]12[C@@H]([C@H]([C@H](O[C@@H]3C=C(C[C@@H]([C@@]13COC(C)=O)O)C)[C@@]12CO1)O)OC(C)=O