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Variecolorin b

  • Formula: C24H30ClN3O3

  • Molecular weight: 444.00

  • Smiles: CC1C(=O)NC(=CC2=C(NC3=C2C=C(C=C3)CC(C(C)(C)O)Cl)C(C)(C)C=C)C(=O)N1

  • Type: Isoechinulin-type Alkaloids V

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Variecolorin b

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

Names

  • Mycotoxin name: Variecolorin b

  • First synonym: Variecolorin b

  • Synonyms: variecolorin B,CHEMBL250873

Identifiers / External links

Structure

  • Smiles: CC1C(=O)NC(=CC2=C(NC3=C2C=C(C=C3)CC(C(C)(C)O)Cl)C(C)(C)C=C)C(=O)N1

  • Isomeric smiles: C[C@H]1C(=O)N/C(=C\C2=C(NC3=C2C=C(C=C3)C[C@H](C(C)(C)O)Cl)C(C)(C)C=C)/C(=O)N1

  • Inchi: InChI=1S/C24H30ClN3O3/c1-7-23(3,4)20-16(12-18-22(30)26-13(2)21(29)28-18)15-10-14(8-9-17(15)27-20)11-19(25)24(5,6)31/h7-10,12-13,19,27,31H,1,11H2,2-6H3,(H,26,30)(H,28,29)/b18-12-/t13-,19+/m0/s1

  • Inchikey: VIKMWNKSZYUXNW-RKFKHAPCSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C24H30ClN3O3

  • Molecular weight: 444.00

  • Monoisotopic mass: 443.1975695

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