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Kodaistatin a

  • Formula: C35H34O11

  • Molecular weight: 630.60

  • Smiles: CCC(C)C=C(C)C=CC(=O)CC1=C(C(C(C1=O)O)(C(=O)C)O)C2=CC(=C(C=C2C3=C(C(=CC4=CC=C(C=C4)O)OC3=O)O)O)O

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Kodaistatin a

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

Names

  • Mycotoxin name: Kodaistatin a

  • First synonym: Kodaistatin a

  • Synonyms: Kodaistatin A

Identifiers / External links

Structure

  • Smiles: CCC(C)C=C(C)C=CC(=O)CC1=C(C(C(C1=O)O)(C(=O)C)O)C2=CC(=C(C=C2C3=C(C(=CC4=CC=C(C=C4)O)OC3=O)O)O)O

  • Isomeric smiles: CCC(C)/C=C(\C)/C=C/C(=O)CC1=C(C(C(C1=O)O)(C(=O)C)O)C2=CC(=C(C=C2C3=C(/C(=C/C4=CC=C(C=C4)O)/OC3=O)O)O)O

  • Inchi: InChI=1S/C35H34O11/c1-5-17(2)12-18(3)6-9-22(38)14-25-30(35(45,19(4)36)33(43)31(25)41)24-16-27(40)26(39)15-23(24)29-32(42)28(46-34(29)44)13-20-7-10-21(37)11-8-20/h6-13,15-17,33,37,39-40,42-43,45H,5,14H2,1-4H3/b9-6+,18-12+,28-13-

  • Inchikey: YACYONYLJTYMLP-AIXQLNHRSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C35H34O11

  • Molecular weight: 630.60

  • Monoisotopic mass: 630.2101119

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