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blennolide e

  • Formula: C16H16O8

  • Molecular weight: 336.29

  • Smiles: CC1C(C(=O)OC1C2(CC(=O)C3=C(C=CC=C3O2)O)C(=O)OC)O

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blennolide e

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

Names

  • Mycotoxin name: blennolide e

  • First synonym: None

  • Synonyms: Blennolide E,methyl (2R)-5-hydroxy-2-[(2S,3S,4R)-4-hydroxy-3-methyl-5-oxooxolan-2-yl]-4-oxo-3H-chromene-2-carboxylate,Methyl (2R)-5-hydroxy-2-((2S,3S,4R)-4-hydroxy-3-methyl-5-oxooxolan-2-yl)-4-oxo-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid,methyl (2R)-5-hydroxy-2-((2S,3S,4R)-4-hydroxy-3-methyl-5-oxooxolan-2-yl)-4-oxo-3H-chromene-2-carboxylate,Methyl (2R)-5-hydroxy-2-[(2S,3S,4R)-4-hydroxy-3-methyl-5-oxooxolan-2-yl]-4-oxo-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid,CHEBI:216481

Identifiers / External links

Structure

  • Smiles: CC1C(C(=O)OC1C2(CC(=O)C3=C(C=CC=C3O2)O)C(=O)OC)O

  • Isomeric smiles: C[C@H]1[C@H](C(=O)O[C@@H]1[C@]2(CC(=O)C3=C(C=CC=C3O2)O)C(=O)OC)O

  • Inchi: InChI=1S/C16H16O8/c1-7-12(19)14(20)23-13(7)16(15(21)22-2)6-9(18)11-8(17)4-3-5-10(11)24-16/h3-5,7,12-13,17,19H,6H2,1-2H3/t7-,12+,13-,16+/m0/s1

  • Inchikey: OMVHTLWAVUQCOT-RBFYFKTFSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C16H16O8

  • Molecular weight: 336.29

  • Monoisotopic mass: 336.08451746

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