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Substance Name: Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-(3-methylbutanoate)
RN: 42461-85-8
InChIKey: BXFOFFBJRFZBQZ-FZUHTSTPSA-N

Molecular Weight

  • 466.5236
 
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Names and Synonyms

  • Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-(3-methylbutanoate)

Registry Numbers

CAS Registry Number

  • 42461-85-8

System Generated Number

  • 0042461858

Structure Descriptors

InChI

1S/C24H34O9/c1-12(2)7-18(27)32-16-9-23(10-29-14(4)25)17(8-13(16)3)33-21-19(28)20(31-15(5)26)22(23,6)24(21)11-30-24/h8,12,16-17,19-21,28H,7,9-11H2,1-6H3/t16?,17-,19?,20?,21-,22-,23-,24?/m1/s1

InChIKey

BXFOFFBJRFZBQZ-FZUHTSTPSA-N

Smiles

CC1=C[C@@H]2[C@](CC1OC(=O)CC(C)C)([C@]3(C(C([C@H](C34CO4)O2)O)OC(=O)C)C)COC(=O)C