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Pyripyropene q

  • Formula: C30H37NO8

  • Molecular weight: 539.60

  • Smiles: CCC(=O)OCC1(C2CCC3(C(C2(CCC1OC(=O)C)C)C(C4=C(O3)C=C(OC4=O)C5=CN=CC=C5)O)C)C

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Pyripyropene q

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

  • Mycotoxin name: Pyripyropene q

  • First synonym: Pyripyropene q

  • Synonyms: Pyripyropene Q

Identifiers / External links

Structure

  • Smiles: CCC(=O)OCC1(C2CCC3(C(C2(CCC1OC(=O)C)C)C(C4=C(O3)C=C(OC4=O)C5=CN=CC=C5)O)C)C

  • Isomeric smiles: CCC(=O)OC[C@]1([C@@H]2CC[C@@]3([C@@H]([C@]2(CC[C@@H]1OC(=O)C)C)[C@H](C4=C(O3)C=C(OC4=O)C5=CN=CC=C5)O)C)C

  • Inchi: InChI=1S/C30H37NO8/c1-6-23(33)36-16-29(4)21-9-12-30(5)26(28(21,3)11-10-22(29)37-17(2)32)25(34)24-20(39-30)14-19(38-27(24)35)18-8-7-13-31-15-18/h7-8,13-15,21-22,25-26,34H,6,9-12,16H2,1-5H3/t21-,22+,25+,26-,28+,29+,30-/m1/s1

  • Inchikey: LEDIGZYYICRNSS-JFNWYRHFSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C30H37NO8

  • Molecular weight: 539.60

  • Monoisotopic mass: 539.25191714

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