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Berkeleyamide a

  • Formula: C18H25NO3

  • Molecular weight: 303.40

  • Smiles: CC(C)CC1CC(C(=O)N1)C(CC(=O)CC2=CC=CC=C2)O

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Berkeleyamide a

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

Names

  • Mycotoxin name: Berkeleyamide a

  • First synonym: Berkeleyamide a

  • Synonyms: Berkeleyamide A,CHEMBL466565,Berkeleamide A,BDBM50261541

Identifiers / External links

Structure

  • Smiles: CC(C)CC1CC(C(=O)N1)C(CC(=O)CC2=CC=CC=C2)O

  • Isomeric smiles: CC(C)C[C@H]1C[C@@H](C(=O)N1)[C@H](CC(=O)CC2=CC=CC=C2)O

  • Inchi: InChI=1S/C18H25NO3/c1-12(2)8-14-10-16(18(22)19-14)17(21)11-15(20)9-13-6-4-3-5-7-13/h3-7,12,14,16-17,21H,8-11H2,1-2H3,(H,19,22)/t14-,16+,17-/m0/s1

  • Inchikey: KACACYYTPVUKSL-UAGQMJEPSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C18H25NO3

  • Molecular weight: 303.40

  • Monoisotopic mass: 303.18344366

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