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Berkeleyamide d

  • Formula: C18H21NO5

  • Molecular weight: 331.40

  • Smiles: CC(C)CC1(C(C2(C(=O)C=C(O2)CC3=CC=CC=C3)C(=O)N1)O)O

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Berkeleyamide d

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

Names

  • Mycotoxin name: Berkeleyamide d

  • First synonym: Berkeleyamide d

  • Synonyms: Berkeleyamide D,CHEMBL466747,BDBM50261569

Identifiers / External links

Structure

  • Smiles: CC(C)CC1(C(C2(C(=O)C=C(O2)CC3=CC=CC=C3)C(=O)N1)O)O

  • Isomeric smiles: CC(C)CC1(C(C2(C(=O)C=C(O2)CC3=CC=CC=C3)C(=O)N1)O)O

  • Inchi: InChI=1S/C18H21NO5/c1-11(2)10-17(23)15(21)18(16(22)19-17)14(20)9-13(24-18)8-12-6-4-3-5-7-12/h3-7,9,11,15,21,23H,8,10H2,1-2H3,(H,19,22)

  • Inchikey: KYPWBBBOBAOGSQ-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C18H21NO5

  • Molecular weight: 331.40

  • Monoisotopic mass: 331.14197277

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