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Pyripyropene F

  • Formula: C28H35NO5

  • Molecular weight: 465.60

  • Smiles: CCC(=O)OC1CCC2(C(C1(C)C)CCC3(C2CC4=C(O3)C=C(OC4=O)C5=CN=CC=C5)C)C

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Pyripyropene F

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

  • Mycotoxin name: Pyripyropene F

  • First synonym: None

  • Synonyms: Pyripyropene F,[(1R,2S,5S,7R,10R)-2,6,6,10-tetramethyl-16-oxo-14-pyridin-3-yl-11,15-dioxatetracyclo[8.8.0.02,7.012,17]octadeca-12(17),13-dien-5-yl] propanoate,((1R,2S,5S,7R,10R)-2,6,6,10-tetramethyl-16-oxo-14-pyridin-3-yl-11,15-dioxatetracyclo(8.8.0.02,7.012,17)octadeca-12(17),13-dien-5-yl) propanoate,CHEBI:227319,(5AR,7ar,9S,11as,11BR)-5a,8,8,11a-tetramethyl-1-oxo-3-(pyridin-3-yl)-1,5a,6,7,7a,8,9,10,11,11a,11b,12-dodecahydro-2,5-dioxatetraphen-9-yl propanoic acid

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Structure

  • Smiles: CCC(=O)OC1CCC2(C(C1(C)C)CCC3(C2CC4=C(O3)C=C(OC4=O)C5=CN=CC=C5)C)C

  • Isomeric smiles: CCC(=O)O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]3([C@@H]2CC4=C(O3)C=C(OC4=O)C5=CN=CC=C5)C)C

  • Inchi: InChI=1S/C28H35NO5/c1-6-24(30)33-23-10-11-27(4)21(26(23,2)3)9-12-28(5)22(27)14-18-20(34-28)15-19(32-25(18)31)17-8-7-13-29-16-17/h7-8,13,15-16,21-23H,6,9-12,14H2,1-5H3/t21-,22+,23-,27-,28+/m0/s1

  • Inchikey: JIHRIBKMEVTBGP-ZRLOAUAMSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C28H35NO5

  • Molecular weight: 465.60

  • Monoisotopic mass: 465.25152322

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