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Miyakamide a2

  • Formula: C31H32N4O3

  • Molecular weight: 508.60

  • Smiles: CC(=O)NC(CC1=CC=CC=C1)C(=O)N(C)C(CC2=CC=CC=C2)C(=O)NC=CC3=CNC4=CC=CC=C43

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Miyakamide a2

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

Names

  • Mycotoxin name: Miyakamide a2

  • First synonym: Miyakamide a2

  • Synonyms: Miyakamide A2

Identifiers / External links

Structure

  • Smiles: CC(=O)NC(CC1=CC=CC=C1)C(=O)N(C)C(CC2=CC=CC=C2)C(=O)NC=CC3=CNC4=CC=CC=C43

  • Isomeric smiles: CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N/C=C/C3=CNC4=CC=CC=C43

  • Inchi: InChI=1S/C31H32N4O3/c1-22(36)34-28(19-23-11-5-3-6-12-23)31(38)35(2)29(20-24-13-7-4-8-14-24)30(37)32-18-17-25-21-33-27-16-10-9-15-26(25)27/h3-18,21,28-29,33H,19-20H2,1-2H3,(H,32,37)(H,34,36)/b18-17+/t28-,29-/m0/s1

  • Inchikey: NNICSBNBJLZHOU-LBBURDNXSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C31H32N4O3

  • Molecular weight: 508.60

  • Monoisotopic mass: 508.2474409

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