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Pithomycolide

  • Formula: C30H36N2O8

  • Molecular weight: 552.60

  • Smiles: CC1C(=O)OC(CC(=O)OC(CC(=O)OC(C(=O)N(C(C(=O)N1)C)C)C(C)C)C2=CC=CC=C2)C3=CC=CC=C3

  • Type: Cyclodepsipeptide (5 AA)

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Pithomycolide

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

Names

  • Mycotoxin name: Pithomycolide

  • First synonym: None

  • Synonyms: Pithomycolide,3,6,7-trimethyl-13,17-diphenyl-9-propan-2-yl-1,10,14-trioxa-4,7-diazacycloheptadecane-2,5,8,11,15-pentone,CHEBI:199909

Identifiers / External links

Structure

  • Smiles: CC1C(=O)OC(CC(=O)OC(CC(=O)OC(C(=O)N(C(C(=O)N1)C)C)C(C)C)C2=CC=CC=C2)C3=CC=CC=C3

  • Isomeric smiles: CC1C(=O)OC(CC(=O)OC(CC(=O)OC(C(=O)N(C(C(=O)N1)C)C)C(C)C)C2=CC=CC=C2)C3=CC=CC=C3

  • Inchi: InChI=1S/C30H36N2O8/c1-18(2)27-29(36)32(5)20(4)28(35)31-19(3)30(37)39-24(22-14-10-7-11-15-22)17-25(33)38-23(16-26(34)40-27)21-12-8-6-9-13-21/h6-15,18-20,23-24,27H,16-17H2,1-5H3,(H,31,35)

  • Inchikey: PRZLSSSUPGEMFV-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C30H36N2O8

  • Molecular weight: 552.60

  • Monoisotopic mass: 552.24716611

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Fungi

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