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VM-55599

  • Formula: C22H27N3O

  • Molecular weight: 349.50

  • Smiles: CC1CCN2C13CC4C(C5=C(CC4(C2)NC3=O)C6=CC=CC=C6N5)(C)C

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VM-55599

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

Names

  • Mycotoxin name: VM-55599

  • First synonym: None

  • Synonyms: VM-55599,CHEBI:197655,(1S,13S,15R,16R)-12,12,16-trimethyl-10,19,21-triazahexacyclo[13.5.2.01,13.03,11.04,9.015,19]docosa-3(11),4,6,8-tetraen-22-one

Identifiers / External links

Structure

  • Smiles: CC1CCN2C13CC4C(C5=C(CC4(C2)NC3=O)C6=CC=CC=C6N5)(C)C

  • Isomeric smiles: C[C@@H]1CCN2[C@]13C[C@@H]4[C@](C2)(CC5=C(C4(C)C)NC6=CC=CC=C56)NC3=O

  • Inchi: InChI=1S/C22H27N3O/c1-13-8-9-25-12-21-10-15-14-6-4-5-7-16(14)23-18(15)20(2,3)17(21)11-22(13,25)19(26)24-21/h4-7,13,17,23H,8-12H2,1-3H3,(H,24,26)/t13-,17+,21-,22-/m1/s1

  • Inchikey: FBXHMCWNISYEEV-FXQDWMKTSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C22H27N3O

  • Molecular weight: 349.50

  • Monoisotopic mass: 349.215412493

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Fungi

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