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Aspochalasin e

  • Formula: C24H37NO5

  • Molecular weight: 419.60

  • Smiles: CC1C2C(NC(=O)C23C(C=C(CCC(C(C(CC3=O)O)O)O)C)C=C1C)CC(C)C

  • Type: Cytochalasan

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Aspochalasin e

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

Names

  • Mycotoxin name: Aspochalasin e

  • First synonym: Aspochalasin e

  • Synonyms: aspochalasin E,CHEMBL516341

Identifiers / External links

Structure

  • Smiles: CC1C2C(NC(=O)C23C(C=C(CCC(C(C(CC3=O)O)O)O)C)C=C1C)CC(C)C

  • Isomeric smiles: CC1C2C(NC(=O)C23C(/C=C(/CCC(C(C(CC3=O)O)O)O)\C)C=C1C)CC(C)C

  • Inchi: InChI=1S/C24H37NO5/c1-12(2)8-17-21-15(5)14(4)10-16-9-13(3)6-7-18(26)22(29)19(27)11-20(28)24(16,21)23(30)25-17/h9-10,12,15-19,21-22,26-27,29H,6-8,11H2,1-5H3,(H,25,30)/b13-9+

  • Inchikey: PLGNVFSTPJUFKJ-UKTHLTGXSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C24H37NO5

  • Molecular weight: 419.60

  • Monoisotopic mass: 419.26717328

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