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Phenochalasin a

  • Formula: C28H33NO7

  • Molecular weight: 495.60

  • Smiles: CC1CC=CC2C=C(C(C3C2(C(=O)NC3CC4=CC=C(C=C4)O)OC(=O)OC=CC(C1=O)(C)O)C)C

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Phenochalasin a

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

Names

  • Mycotoxin name: Phenochalasin a

  • First synonym: Phenochalasin a

  • Synonyms: phenochalasin a

Identifiers / External links

Structure

  • Smiles: CC1CC=CC2C=C(C(C3C2(C(=O)NC3CC4=CC=C(C=C4)O)OC(=O)OC=CC(C1=O)(C)O)C)C

  • Isomeric smiles: CC1C/C=C/C2C=C(C(C3C2(C(=O)NC3CC4=CC=C(C=C4)O)OC(=O)O/C=C\C(C1=O)(C)O)C)C

  • Inchi: InChI=1S/C28H33NO7/c1-16-6-5-7-20-14-17(2)18(3)23-22(15-19-8-10-21(30)11-9-19)29-25(32)28(20,23)36-26(33)35-13-12-27(4,34)24(16)31/h5,7-14,16,18,20,22-23,30,34H,6,15H2,1-4H3,(H,29,32)/b7-5+,13-12-

  • Inchikey: UWGGHVBZMJIJSU-RTOCWKKDSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C28H33NO7

  • Molecular weight: 495.60

  • Monoisotopic mass: 495.22570239

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