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Tropolactone c

  • Formula: C26H32O6

  • Molecular weight: 440.50

  • Smiles: CC1=C(C(=O)C(=C2C(=C1)CC3C(O2)(CCC4C3(C=CC(=O)OC4(C)C)C)C)C)C(=O)OC

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Tropolactone c

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

  • Mycotoxin name: Tropolactone c

  • First synonym: Tropolactone c

  • Synonyms: Tropolactone C

Identifiers / External links

Structure

  • Smiles: CC1=C(C(=O)C(=C2C(=C1)CC3C(O2)(CCC4C3(C=CC(=O)OC4(C)C)C)C)C)C(=O)OC

  • Isomeric smiles: CC1=C(C(=O)C(=C2C(=C1)C[C@@H]3[C@@](O2)(CC[C@@H]4[C@@]3(C=CC(=O)OC4(C)C)C)C)C)C(=O)OC

  • Inchi: InChI=1S/C26H32O6/c1-14-12-16-13-18-25(5)10-9-19(27)31-24(3,4)17(25)8-11-26(18,6)32-22(16)15(2)21(28)20(14)23(29)30-7/h9-10,12,17-18H,8,11,13H2,1-7H3/t17-,18-,25-,26-/m0/s1

  • Inchikey: IAPFNCDIAZGJJT-JZWJADFXSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C26H32O6

  • Molecular weight: 440.50

  • Monoisotopic mass: 440.21988874

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