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Trichodermadienediol a

  • Formula: C23H32O6

  • Molecular weight: 404.50

  • Smiles: CC1=CC2C(CC1)(C3(C(CC(C34CO4)O2)OC(=O)C=CC=CC(C(C)O)O)C)C

  • Type: Trichothecene

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Trichodermadienediol a

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

Names

  • Mycotoxin name: Trichodermadienediol a

  • First synonym: Trichodermadienediol a

  • Synonyms: Trichodermadienediol A

Identifiers / External links

Structure

  • Smiles: CC1=CC2C(CC1)(C3(C(CC(C34CO4)O2)OC(=O)C=CC=CC(C(C)O)O)C)C

  • Isomeric smiles: CC1=C[C@@H]2[C@](CC1)([C@]3([C@@H](C[C@H]([C@@]34CO4)O2)OC(=O)/C=C\C=C\[C@@H]([C@H](C)O)O)C)C

  • Inchi: InChI=1S/C23H32O6/c1-14-9-10-21(3)17(11-14)28-19-12-18(22(21,4)23(19)13-27-23)29-20(26)8-6-5-7-16(25)15(2)24/h5-8,11,15-19,24-25H,9-10,12-13H2,1-4H3/b7-5+,8-6-/t15-,16-,17+,18+,19+,21-,22+,23-/m0/s1

  • Inchikey: MUIQEOKJENXWJC-IDGGXFNDSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C23H32O6

  • Molecular weight: 404.50

  • Monoisotopic mass: 404.21988874

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