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(3alpha,4beta,8alpha)-12,13-epoxytrichothec-9-ene-3,4,8,15-tetrol 4,15-diacetate 8-(3-methylbutyrate)
SpectraBase Compound ID CuYH9deDvlz
InChI 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+/m0/s1
InChIKey BXFOFFBJRFZBQZ-AUBNQNLXSA-N
Mol Weight 466.5 g/mol
Molecular Formula C24H34O9
Exact Mass 466.220283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JWcUkdgemS
Name (3alpha,4beta,8alpha)-12,13-epoxytrichothec-9-ene-3,4,8,15-tetrol 4,15-diacetate 8-(3-methylbutyrate)
CAS Registry Number 21259-20-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H34O9
InChI 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+/m0/s1
InChIKey BXFOFFBJRFZBQZ-AUBNQNLXSA-N
Molecular Weight 466.527 g/mol
SMILES OC1[C@]2([C@]3([C@](C)([C@@]4([C@@](O2)(C=C(C(C4)OC(CC(C)C)=O)C)[H])COC(C)=O)C1OC(C)=O)OC3)[H]
SPLASH splash10-0214-1941000000-d43d0ae09f8f463aa5c6
Source of Spectrum MY-1981-0-0
Synonyms 12,13-Epoxytrichothec-9-ene-3,4,8,15-tetrol 4,15-diacetate 8-(3-methylbutanoate) 12,13-Epoxytrichothec-9-ene-3-alpha,4-beta,8-alpha,15-tetrol 4,15-diacetate 8-isovalerate 12,13-Trichothecene 3-Hydroxy-4,15-diacetoxy-8-(3-methylbutyryloxy)-12,13-epoxy-delta(sup 9)-trichothecene 3-Hydroxy-4,15-diacetoxy-8-(3-methylbutyryloxy)-12,13-epoxy-delta-9-trichothecene 4,15-Diacetoxy-8-(3-methylbutyryloxy)-12,13-epoxy-delta-9-trichothecen-3-ol 4,15-Diacetoxy-8-(3-methylbutyryloxy)scirp-9-en-3-ol 8-(3-Methylbutyryloxy)-diacetoxyscirpenol Fusariotoxine T2 Isaritoxin Mycotoxin T-2 t(sub 2)-trichothecene t2-trichothecene Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-(3-methylbutanoate), (3alpha,4beta,8alpha)- Trichothec-9-ene-3-alpha,4-beta,8-alpha,15-tetrol, 12,13-epoxy-, 4,15-diacetate 8-isovalerate CCRIS 3456 EINECS 244-297-7 HSDB 3544
Wiley ID 1391920