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11-hydroxycurvularin

  • Formula: C16H20O6

  • Molecular weight: 308.33

  • Smiles: CC1CCCC(CC(=O)C2=C(CC(=O)O1)C=C(C=C2O)O)O

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11-hydroxycurvularin

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

  • Mycotoxin name: 11-hydroxycurvularin

  • First synonym: 11-hydroxycurvularin

  • Synonyms: 11-hydroxycurvularin,CHEMBL520015

Identifiers / External links

Structure

  • Smiles: CC1CCCC(CC(=O)C2=C(CC(=O)O1)C=C(C=C2O)O)O

  • Isomeric smiles: C[C@H]1CCCC(CC(=O)C2=C(CC(=O)O1)C=C(C=C2O)O)O

  • Inchi: InChI=1S/C16H20O6/c1-9-3-2-4-11(17)7-13(19)16-10(6-15(21)22-9)5-12(18)8-14(16)20/h5,8-9,11,17-18,20H,2-4,6-7H2,1H3/t9-,11?/m0/s1

  • Inchikey: QPBNFQKLPIXNFL-FTNKSUMCSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C16H20O6

  • Molecular weight: 308.33

  • Monoisotopic mass: 308.12598835

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