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Tricitrinol a

  • Formula: C37H44O9

  • Molecular weight: 632.70

  • Smiles: CC1C(OC(C2=C(C=C(C(=C12)C)O)O)C3=C(C(=C4C(C(OC5C4=C3OC6=C7C(OC(C(C7=C(C(=C56)O)C)C)C)OC)C)C)C)O)C

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Tricitrinol a

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

Names

  • Mycotoxin name: Tricitrinol a

  • First synonym: Tricitrinol a

  • Synonyms: Tricitrinol A,CHEMBL1822981

Identifiers / External links

Structure

  • Smiles: CC1C(OC(C2=C(C=C(C(=C12)C)O)O)C3=C(C(=C4C(C(OC5C4=C3OC6=C7C(OC(C(C7=C(C(=C56)O)C)C)C)OC)C)C)C)O)C

  • Isomeric smiles: C[C@@H]1[C@H](O[C@@H](C2=C(C=C(C(=C12)C)O)O)C3=C(C(=C4[C@@H]([C@H](O[C@@H]5C4=C3OC6=C7[C@H](O[C@@H]([C@H](C7=C(C(=C56)O)C)C)C)OC)C)C)C)O)C

  • Inchi: InChI=1S/C37H44O9/c1-12-18(7)43-33(26-22(39)11-21(38)15(4)23(12)26)29-31(40)16(5)24-13(2)19(8)44-34-27(24)35(29)46-36-28-25(17(6)32(41)30(34)36)14(3)20(9)45-37(28)42-10/h11-14,18-20,33-34,37-41H,1-10H3/t12-,13-,14-,18-,19-,20-,33+,34-,37+/m1/s1

  • Inchikey: DYDDLIPFZTXTKD-HFFYXFNSSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C37H44O9

  • Molecular weight: 632.70

  • Monoisotopic mass: 632.29853298

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