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Phomadecalin d

  • Formula: C15H20O4

  • Molecular weight: 264.32

  • Smiles: CC1C(C=CC2=CC(C3(C(C12C)O3)C(=C)CO)O)O

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Phomadecalin d

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

Names

  • Mycotoxin name: Phomadecalin d

  • First synonym: Phomadecalin d

  • Synonyms: phomadecalin D,CHEMBL460861

Identifiers / External links

Structure

  • Smiles: CC1C(C=CC2=CC(C3(C(C12C)O3)C(=C)CO)O)O

  • Isomeric smiles: C[C@H]1[C@@H](C=CC2=C[C@H]([C@]3([C@@H]([C@]12C)O3)C(=C)CO)O)O

  • Inchi: InChI=1S/C15H20O4/c1-8(7-16)15-12(18)6-10-4-5-11(17)9(2)14(10,3)13(15)19-15/h4-6,9,11-13,16-18H,1,7H2,2-3H3/t9-,11+,12+,13+,14+,15-/m0/s1

  • Inchikey: LLKUBNIUIWQJBY-ARYYTZDLSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C15H20O4

  • Molecular weight: 264.32

  • Monoisotopic mass: 264.13615911

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