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Isosativenetriol

  • Formula: C15H24O3

  • Molecular weight: 252.35

  • Smiles: CC12CCC(C3C1C(C(C3O)C2=C)O)C(C)(C)O

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Isosativenetriol

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

  • Mycotoxin name: Isosativenetriol

  • First synonym: Isosativenetriol

  • Synonyms: Isosativenetriol

Identifiers / External links

Structure

  • Smiles: CC12CCC(C3C1C(C(C3O)C2=C)O)C(C)(C)O

  • Isomeric smiles: CC12CC[C@@H]([C@H]3[C@@H]1C(C(C3O)C2=C)O)C(C)(C)O

  • Inchi: InChI=1S/C15H24O3/c1-7-9-12(16)10-8(14(2,3)18)5-6-15(7,4)11(10)13(9)17/h8-13,16-18H,1,5-6H2,2-4H3/t8-,9?,10-,11+,12?,13?,15?/m0/s1

  • Inchikey: ZAMMUPBTBWXWKL-CVSQCXRCSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C15H24O3

  • Molecular weight: 252.35

  • Monoisotopic mass: 252.17254462

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