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Ankalactone

  • Formula: C18H26O6

  • Molecular weight: 338.40

  • Smiles: CCCCCCCC1=CC2=CC(=O)OC2C(C1(C(=O)OC)O)(C)O

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Ankalactone

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

Names

  • Mycotoxin name: Ankalactone

  • First synonym: Ankalactone

  • Synonyms: Ankalactone,135722-30-4

Identifiers / External links

Structure

  • Smiles: CCCCCCCC1=CC2=CC(=O)OC2C(C1(C(=O)OC)O)(C)O

  • Isomeric smiles: CCCCCCCC1=CC2=CC(=O)O[C@@H]2[C@@]([C@]1(C(=O)OC)O)(C)O

  • Inchi: InChI=1S/C18H26O6/c1-4-5-6-7-8-9-13-10-12-11-14(19)24-15(12)17(2,21)18(13,22)16(20)23-3/h10-11,15,21-22H,4-9H2,1-3H3/t15-,17+,18-/m0/s1

  • Inchikey: ISIUIMTUNVCMGZ-JQHSSLGASA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C18H26O6

  • Molecular weight: 338.40

  • Monoisotopic mass: 338.17293854

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