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Penicitrinol i

  • Formula: C15H20O4

  • Molecular weight: 264.32

  • Smiles: CC1C(OC2CC(OC3=C2C1=C(C(=C3)O)C)(C)O)C

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Penicitrinol i

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

  • Mycotoxin name: Penicitrinol i

  • First synonym: Penicitrinol i

  • Synonyms: Penicitrinol I

Identifiers / External links

Structure

  • Smiles: CC1C(OC2CC(OC3=C2C1=C(C(=C3)O)C)(C)O)C

  • Isomeric smiles: C[C@@H]1[C@H](O[C@H]2C[C@@](OC3=C2C1=C(C(=C3)O)C)(C)O)C

  • Inchi: InChI=1S/C15H20O4/c1-7-9(3)18-12-6-15(4,17)19-11-5-10(16)8(2)13(7)14(11)12/h5,7,9,12,16-17H,6H2,1-4H3/t7-,9-,12+,15+/m1/s1

  • Inchikey: LIDCFZYKZYLCJT-ARYGOODISA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C15H20O4

  • Molecular weight: 264.32

  • Monoisotopic mass: 264.13615911

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