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Bovinone

  • Formula: C26H36O4

  • Molecular weight: 412.60

  • Smiles: CC(=CCCC(=CCCC(=CCCC(=CCC1=C(C(=O)C=C(C1=O)O)O)C)C)C)C

  • Type: Benzoquinone

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Bovinone

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

Names

  • Mycotoxin name: Bovinone

  • First synonym: None

  • Synonyms: Boviquinone 4,Bovinone,28129-52-4,2,5-Dihydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]-2,5-cyclohexadiene-1,4-dione,Bovinon,Boviquinone-4,TFA3BH8YTC,CHEBI:176033,DTXSID501109434,2,5-dihydroxy-3-geranylgeranyl-1,4-benzoquinone,3-Geranylgeranyl-2,5-dihydroxy-1,4-benzoquinone,2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-, (E,E,E)-,2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]-,2,5-dihydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]cyclohexa-2,5-diene-1,4-dione,p-Benzoquinone, 2,5-dihydroxy-3-(3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-, (E,E,E)-

Identifiers / External links

Structure

  • Smiles: CC(=CCCC(=CCCC(=CCCC(=CCC1=C(C(=O)C=C(C1=O)O)O)C)C)C)C

  • Isomeric smiles: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC1=C(C(=O)C=C(C1=O)O)O)/C)/C)/C)C

  • Inchi: InChI=1S/C26H36O4/c1-18(2)9-6-10-19(3)11-7-12-20(4)13-8-14-21(5)15-16-22-25(29)23(27)17-24(28)26(22)30/h9,11,13,15,17,27,30H,6-8,10,12,14,16H2,1-5H3/b19-11+,20-13+,21-15+

  • Inchikey: FXIRKSMTDSBFCE-YKBIRWAZSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C26H36O4

  • Molecular weight: 412.60

  • Monoisotopic mass: 412.26135963

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