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Alternaramide

  • Formula: C33H40N4O6

  • Molecular weight: 588.70

  • Smiles: CC(C)C1C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)N3CCCC3C(=O)O1)CC4=CC=CC=C4)CC5=CC=CC=C5

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Alternaramide

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

Names

  • Mycotoxin name: Alternaramide

  • First synonym: Alternaramide

  • Synonyms: Alternaramide,Alternamide,CHEMBL1077115

Identifiers / External links

Structure

  • Smiles: CC(C)C1C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)N3CCCC3C(=O)O1)CC4=CC=CC=C4)CC5=CC=CC=C5

  • Isomeric smiles: CC(C)[C@H]1C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C(=O)N3CCC[C@H]3C(=O)O1)CC4=CC=CC=C4)CC5=CC=CC=C5

  • Inchi: InChI=1S/C33H40N4O6/c1-21(2)28-30(39)35-25(20-23-13-7-4-8-14-23)31(40)36-17-9-15-26(36)29(38)34-24(19-22-11-5-3-6-12-22)32(41)37-18-10-16-27(37)33(42)43-28/h3-8,11-14,21,24-28H,9-10,15-20H2,1-2H3,(H,34,38)(H,35,39)/t24-,25-,26+,27+,28+/m1/s1

  • Inchikey: IZCWSRIIMBIBGB-MASCHLQQSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C33H40N4O6

  • Molecular weight: 588.70

  • Monoisotopic mass: 588.29478501

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