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Terpeptin

  • Formula: C28H40N4O3

  • Molecular weight: 480.60

  • Smiles: CC(C)C(C(=O)N(C)C(C(C)C)C(=O)NC=CC1=C(NC2=CC=CC=C21)CC=C(C)C)NC(=O)C

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Terpeptin

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

  • Mycotoxin name: Terpeptin

  • First synonym: Terpeptin

  • Synonyms: Terpeptin

Identifiers / External links

  • CAS: 188824-81-9

  • PubChem CID: 9913062

  • Chemical Entities of Biological Interest (CHEBI): CHEBI:209015

Structure

  • Smiles: CC(C)C(C(=O)N(C)C(C(C)C)C(=O)NC=CC1=C(NC2=CC=CC=C21)CC=C(C)C)NC(=O)C

  • Isomeric smiles: CC(C)[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N/C=C\C1=C(NC2=CC=CC=C21)CC=C(C)C)NC(=O)C

  • Inchi: InChI=1S/C28H40N4O3/c1-17(2)13-14-24-22(21-11-9-10-12-23(21)31-24)15-16-29-27(34)26(19(5)6)32(8)28(35)25(18(3)4)30-20(7)33/h9-13,15-16,18-19,25-26,31H,14H2,1-8H3,(H,29,34)(H,30,33)/b16-15-/t25-,26-/m0/s1

  • Inchikey: QKRDCXNLINQVQN-QXYKFECQSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C28H40N4O3

  • Molecular weight: 480.60

  • Monoisotopic mass: 480.31004115

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