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Substance Name: Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 3,15-diacetate 8-(3-methylbutanoate), (3alpha,4beta,8alpha)-
RN: 34084-03-2
InChIKey: SBEUAAIAYCUUJR-QYWOHJEZSA-N

Molecular Formula

  • C24-H34-O9

Molecular Weight

  • 466.5236
 
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Names and Synonyms

Synonym

  • Trichothec-9-ene-3alpha,4beta,8.lpha,15-tetrol, 12,13-epoxy-, 3,15-diacetate 8-isovalerate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 34084-03-2

System Generated Number

  • 0034084032

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(31-15(5)26)20(28)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-/m0/s1

InChIKey

SBEUAAIAYCUUJR-QYWOHJEZSA-N

Smiles

CC1=C[C@@H]2[C@](C[C@@H]1OC(=O)CC(C)C)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)OC(=O)C)O)C)COC(=O)C