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Cochliodone b

  • Formula: C32H34O12

  • Molecular weight: 610.60

  • Smiles: CC(=O)OC1(C(=O)C2=COC3(CCCCO3)CC2=C(C1=O)C4=C5CC6(CCCCO6)OC=C5C(=O)C(C4=O)(C)OC(=O)C)C

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Cochliodone b

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

Names

  • Mycotoxin name: Cochliodone b

  • First synonym: Cochliodone b

  • Synonyms: Cochliodone B,J3.642.224F,J3.642.225D

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Structure

  • Smiles: CC(=O)OC1(C(=O)C2=COC3(CCCCO3)CC2=C(C1=O)C4=C5CC6(CCCCO6)OC=C5C(=O)C(C4=O)(C)OC(=O)C)C

  • Isomeric smiles: CC(=O)O[C@@]1(C(=O)C2=CO[C@]3(CCCCO3)CC2=C(C1=O)C4=C5C[C@@]6(CCCCO6)OC=C5C(=O)[C@@](C4=O)(C)OC(=O)C)C

  • Inchi: InChI=1S/C32H34O12/c1-17(33)43-29(3)25(35)21-15-41-31(9-5-7-11-39-31)13-19(21)23(27(29)37)24-20-14-32(10-6-8-12-40-32)42-16-22(20)26(36)30(4,28(24)38)44-18(2)34/h15-16H,5-14H2,1-4H3/t29-,30-,31-,32-/m1/s1

  • Inchikey: BHRDWMOKKWCKJL-SEVDZJIVSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C32H34O12

  • Molecular weight: 610.60

  • Monoisotopic mass: 610.20502652

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Fungi

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