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12,13-Epoxytrichothec-9-en-8-ol, (8beta)-

  • Formula: C15H22O3

  • Molecular weight: 250.33

  • Smiles: CC1=CC2C(CC1O)(C3(CCC(C34CO4)O2)C)C

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12,13-Epoxytrichothec-9-en-8-ol, (8beta)-

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
Fungi

Names

  • Mycotoxin name: 12,13-Epoxytrichothec-9-en-8-ol, (8beta)-

  • First synonym: None

  • Synonyms: 8LE38P9SAI,UNII-8LE38P9SAI,12,13-Epoxytrichothec-9-en-8-ol, (8beta)-,(8beta)-12,13-Epoxytrichothec-9-en-8-ol,104903-78-8,Trichothec-9-en-8-ol, 12,13-epoxy-, (8beta)-,(8.BETA.)-12,13-EPOXYTRICHOTHEC-9-EN-8-OL,TRICHOTHEC-9-EN-8-OL, 12,13-EPOXY-, (8.BETA.)-

Identifiers / External links

Structure

  • Smiles: CC1=CC2C(CC1O)(C3(CCC(C34CO4)O2)C)C

  • Isomeric smiles: CC1=C[C@@H]2[C@](C[C@H]1O)([C@]3(CC[C@H]([C@@]34CO4)O2)C)C

  • Inchi: InChI=1S/C15H22O3/c1-9-6-12-13(2,7-10(9)16)14(3)5-4-11(18-12)15(14)8-17-15/h6,10-12,16H,4-5,7-8H2,1-3H3/t10-,11-,12-,13+,14-,15+/m1/s1

  • Inchikey: WPNKGWCTEQJZRZ-LACSLYJWSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C15H22O3

  • Molecular weight: 250.33

  • Monoisotopic mass: 250.15689456

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Fungi

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