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Epicoccin c

  • Formula: C18H18N2O6S4

  • Molecular weight: 486.60

  • Smiles: C1C2C(C3C(C1=O)CC4(N3C(=O)C56CC7C(N5C4=O)C(C(CC7=O)SS6)O)SS2)O

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Epicoccin c

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

Names

  • Mycotoxin name: Epicoccin c

  • First synonym: Epicoccin c

  • Synonyms: epicoccin C

Identifiers / External links

Structure

  • Smiles: C1C2C(C3C(C1=O)CC4(N3C(=O)C56CC7C(N5C4=O)C(C(CC7=O)SS6)O)SS2)O

  • Isomeric smiles: C1[C@@H]2[C@@H]([C@@H]3[C@H](C1=O)C[C@@]4(N3C(=O)[C@]56C[C@@H]7[C@H](N5C4=O)[C@H]([C@@H](CC7=O)SS6)O)SS2)O

  • Inchi: InChI=1S/C18H18N2O6S4/c21-7-1-9-13(23)11-5(7)3-17(29-27-9)15(25)20-12-6-4-18(20,16(26)19(11)17)30-28-10(14(12)24)2-8(6)22/h5-6,9-14,23-24H,1-4H2/t5-,6-,9+,10+,11-,12-,13-,14-,17+,18+/m0/s1

  • Inchikey: JPUPMIVLDVVGIE-DXOBHMFTSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C18H18N2O6S4

  • Molecular weight: 486.60

  • Monoisotopic mass: 486.00477099

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