fudecalone

  • Formula: C15H22O3

  • Molecular weight: 250.33

  • Smiles: CC1=CC(=O)C2C(CCCC23C1COC3O)(C)C

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fudecalone

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

Names

  • Mycotoxin name: fudecalone

  • First synonym: (+)-fudecalone

  • Synonyms: (+)-Fudecalone

Identifiers / External links

Structure

  • Smiles: CC1=CC(=O)C2C(CCCC23C1COC3O)(C)C

  • Isomeric smiles: CC1=CC(=O)[C@H]2[C@@]3([C@H]1CO[C@H]3O)CCCC2(C)C

  • Inchi: InChI=1S/C15H22O3/c1-9-7-11(16)12-14(2,3)5-4-6-15(12)10(9)8-18-13(15)17/h7,10,12-13,17H,4-6,8H2,1-3H3/t10-,12+,13+,15-/m0/s1

  • Inchikey: HHSBIKHOYFPWGC-ZGFBFQLVSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C15H22O3

  • Molecular weight: 250.33

  • Monoisotopic mass: 250.15689456

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Fungi