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Solanolone

  • Formula: C15H18O5

  • Molecular weight: 278.30

  • Smiles: CC1=CC2=C(C=C1O)C(=O)C(C3C2C(C(CC3)O)O)O

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Solanolone

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

Names

  • Mycotoxin name: Solanolone

  • First synonym: Solanolone

  • Synonyms: Solanolone,CHEBI:174654,3,4,7,10-tetrahydroxy-6-methyl-2,3,4,4a,10,10a-hexahydro-1H-phenanthren-9-one

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Structure

  • Smiles: CC1=CC2=C(C=C1O)C(=O)C(C3C2C(C(CC3)O)O)O

  • Isomeric smiles: CC1=CC2=C(C=C1O)C(=O)C(C3C2C(C(CC3)O)O)O

  • Inchi: InChI=1S/C15H18O5/c1-6-4-8-9(5-11(6)17)14(19)13(18)7-2-3-10(16)15(20)12(7)8/h4-5,7,10,12-13,15-18,20H,2-3H2,1H3

  • Inchikey: MBBMNXMKZBEZIP-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C15H18O5

  • Molecular weight: 278.30

  • Monoisotopic mass: 278.11542367

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