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Pennicitrinone c

  • Formula: C23H26O6

  • Molecular weight: 398.40

  • Smiles: CC1C(OC2=C3C1=C(C(=O)C=C3OC4=C(C(=C(C(=C24)O)C)C(C)C(C)O)O)C)C

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Pennicitrinone c

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

  • Mycotoxin name: Pennicitrinone c

  • First synonym: Pennicitrinone c

  • Synonyms: pennicitrinone C

Identifiers / External links

Structure

  • Smiles: CC1C(OC2=C3C1=C(C(=O)C=C3OC4=C(C(=C(C(=C24)O)C)C(C)C(C)O)O)C)C

  • Isomeric smiles: C[C@@H]1[C@H](OC2=C3C1=C(C(=O)C=C3OC4=C(C(=C(C(=C24)O)C)[C@H](C)[C@H](C)O)O)C)C

  • Inchi: InChI=1S/C23H26O6/c1-8(12(5)24)17-11(4)20(26)19-22-18-15(29-23(19)21(17)27)7-14(25)10(3)16(18)9(2)13(6)28-22/h7-9,12-13,24,26-27H,1-6H3/t8-,9-,12+,13-/m1/s1

  • Inchikey: HESPWWKIRCFDQL-MNUQUWEESA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C23H26O6

  • Molecular weight: 398.40

  • Monoisotopic mass: 398.17293854

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