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Phomactin a

  • Formula: C20H30O4

  • Molecular weight: 334.40

  • Smiles: CC1CC2C3=C4C1(CCC(=CCCC(O2)(C(C3(OC4)O)O)C)C)C

  • Type: Phomactins

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Phomactin a

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

Names

  • Mycotoxin name: Phomactin a

  • First synonym: Phomactin a

  • Synonyms: Phomactin A,130595-24-3,(1R,3R,4S,7E,11S,12S,13S)-3,4,7,11-Tetramethyl-14,18-dioxatetracyclo[9.6.1.04,16.013,17]octadeca-7,16-diene-12,13-diol

Identifiers / External links

Structure

  • Smiles: CC1CC2C3=C4C1(CCC(=CCCC(O2)(C(C3(OC4)O)O)C)C)C

  • Isomeric smiles: C[C@@H]1C[C@@H]2C3=C4[C@]1(CC/C(=C\CC[C@](O2)([C@@H]([C@]3(OC4)O)O)C)/C)C

  • Inchi: InChI=1S/C20H30O4/c1-12-6-5-8-19(4)17(21)20(22)16-14(11-23-20)18(3,9-7-12)13(2)10-15(16)24-19/h6,13,15,17,21-22H,5,7-11H2,1-4H3/b12-6-/t13-,15-,17+,18+,19+,20+/m1/s1

  • Inchikey: ABEFPCRGBOFMDC-OSERUOPNSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C20H30O4

  • Molecular weight: 334.40

  • Monoisotopic mass: 334.21440943

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