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Substance Name: Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 15-(5-((1,6-dioxo-6-(2-trimethylsilyl)ethoxy)-2,4-hexadienyl)oxy)-3-methyl-2-pentenoate), (4beta,15(2E,5(2E,4E)))-
RN: 88969-02-2
InChIKey: MEFYIHVXKRAJTF-XBWHYSGDSA-N

Molecular Formula

  • C32-H46-O9-Si

Molecular Weight

  • 602.792
 
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Names and Synonyms

  • Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 15-(5-((1,6-dioxo-6-(2-trimethylsilyl)ethoxy)-2,4-hexadienyl)oxy)-3-methyl-2-pentenoate), (4beta,15(2E,5(2E,4E)))-

Registry Numbers

CAS Registry Number

  • 88969-02-2

System Generated Number

  • 0088969022

Structure Descriptors

InChI

1S/C32H46O9Si/c1-22-11-13-31(25(17-22)41-26-19-24(33)30(31,3)32(26)21-40-32)20-39-29(36)18-23(2)12-14-37-27(34)9-7-8-10-28(35)38-15-16-42(4,5)6/h7-10,17-18,24-26,33H,11-16,19-21H2,1-6H3/b9-7+,10-8+,23-18+

InChIKey

MEFYIHVXKRAJTF-XBWHYSGDSA-N

Smiles

C(OCC[Si](C)(C)C)(\C=C\C=C\C(=O)OCC\C(C)=C\C(OC[C@@]12CCC(=C[C@@H]1O[C@@H]1[C@@]3([C@@]2([C@@H](C1)O)C)CO3)C)=O)=O