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Verrucarin k

  • Formula: C27H34O8

  • Molecular weight: 486.60

  • Smiles: CC1CCOC(=O)C=CC=CC(=O)OC2CC3C(=C)C2(C4(CCC(=CC4O3)C)COC(=O)C1O)C

  • Type: Trichothecene

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Verrucarin k

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

Names

  • Mycotoxin name: Verrucarin k

  • First synonym: Verrucarin k

  • Synonyms: Verrucarin K,UNII-4T60YRT2TG,4T60YRT2TG,63739-93-5,BRN 1276841,Verrucarin A, 12,13-deepoxy-12,13-didehydro-,Q27260455,UNII-0457970679 component TVDLZHBXZUICCI-DDXUFAKYSA-N

Identifiers / External links

Structure

  • Smiles: CC1CCOC(=O)C=CC=CC(=O)OC2CC3C(=C)C2(C4(CCC(=CC4O3)C)COC(=O)C1O)C

  • Isomeric smiles: C[C@@H]1CCOC(=O)/C=C/C=C\C(=O)O[C@@H]2C[C@@H]3C(=C)[C@]2([C@]4(CCC(=C[C@H]4O3)C)COC(=O)[C@H]1O)C

  • Inchi: InChI=1S/C27H34O8/c1-16-9-11-27-15-33-25(31)24(30)17(2)10-12-32-22(28)7-5-6-8-23(29)35-20-14-19(34-21(27)13-16)18(3)26(20,27)4/h5-8,13,17,19-21,24,30H,3,9-12,14-15H2,1-2,4H3/b7-5+,8-6-/t17-,19-,20-,21-,24+,26-,27-/m1/s1

  • Inchikey: TVDLZHBXZUICCI-DDXUFAKYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C27H34O8

  • Molecular weight: 486.60

  • Monoisotopic mass: 486.22536804

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