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Substance Name: Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 15-(3-methyl-2,4-pentadienoate), (4beta,15(E))-
RN: 89103-57-1
InChIKey: CEDHVXPOAHYNLN-ARRKEARNSA-N

Molecular Weight

  • 360.4472
 
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Names and Synonyms

  • Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 15-(3-methyl-2,4-pentadienoate), (4beta,15(E))-

Registry Numbers

CAS Registry Number

  • 89103-57-1

System Generated Number

  • 0089103571

Structure Descriptors

InChI

1S/C21H28O5/c1-5-13(2)9-18(23)24-11-20-7-6-14(3)8-16(20)26-17-10-15(22)19(20,4)21(17)12-25-21/h5,8-9,15-17,22H,1,6-7,10-12H2,2-4H3/b13-9+/t15-,16-,17-,19?,20-,21?/m1/s1

InChIKey

CEDHVXPOAHYNLN-ARRKEARNSA-N

Smiles

CC1=C[C@@H]2[C@](CC1)(C3([C@@H](C[C@H](C34CO4)O2)O)C)COC(=O)/C=C(\C)/C=C