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Terrestrol a

  • Formula: C22H22O7

  • Molecular weight: 398.40

  • Smiles: COCC1=C(C=C(C(=C1)O)CC2=C(C=C(C(=C2)O)CC3=C(C=CC(=C3)O)O)O)O

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Terrestrol a

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

Names

  • Mycotoxin name: Terrestrol a

  • First synonym: Terrestrol a

  • Synonyms: Terrestrol A,CHEMBL256568,2-[2,5-Dihydroxy-4-(2,5-dihydroxybenzyl)benzyl]-5-(methoxymethyl)hydroquinone

Identifiers / External links

Structure

  • Smiles: COCC1=C(C=C(C(=C1)O)CC2=C(C=C(C(=C2)O)CC3=C(C=CC(=C3)O)O)O)O

  • Isomeric smiles: COCC1=C(C=C(C(=C1)O)CC2=C(C=C(C(=C2)O)CC3=C(C=CC(=C3)O)O)O)O

  • Inchi: InChI=1S/C22H22O7/c1-29-11-16-10-21(27)15(9-22(16)28)5-14-8-19(25)13(7-20(14)26)4-12-6-17(23)2-3-18(12)24/h2-3,6-10,23-28H,4-5,11H2,1H3

  • Inchikey: WMFZCOHRHOJWON-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C22H22O7

  • Molecular weight: 398.40

  • Monoisotopic mass: 398.13655304

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