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Brevianamide f

  • Formula: C16H17N3O2

  • Molecular weight: 283.32

  • Smiles: C1CC2C(=O)NC(C(=O)N2C1)CC3=CNC4=CC=CC=C43

  • Type: Diketopiperazine (Indole alkaloid)

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Brevianamide f

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

  • Mycotoxin name: Brevianamide f

  • First synonym: Brevianamide f

  • Synonyms: Brevianamide F,38136-70-8,L-prolyl-L-tryptophan anhydride,Cyclo-L-Trp-L-Pro,cyclo-(Trp-Pro),(3s,8as)-3-(1h-Indol-3-Ylmethyl)hexahydropyrrolo[1,2-A]pyrazine-1,4-Dione,cyclo-L-tryptophanyl-L-proline,CHEBI:64530,tryptophan-proline diketopiperazine,L-tryptophyl-L-proline cyclic anhydride,(3S,8aS)-3-((1H-Indol-3-yl)methyl)hexahydropyrrolo[1,2-a]pyrazine-1,4-dione,(3S,8aS)-3-(1H-indol-3-ylmethyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione,cyclo-L-Prolyl-L-tryptophanyl,QRP,Cyclo(L-Pro-L-Trp),Cyclo(L-Trp-L-Pro),cyclo-(L-Trp-L-Pro),cyclo-L-proline-L-pryptophan,cyclo-L-pryptophan-L-proline,Cyclo-L-tryptophyl-L-proline,CHEMBL563557,SCHEMBL2018181,DTXSID10959075,ZINC1582158,Brevianamide F; cyclo-L-Trp-L-Pro,MFCD29917326,s6751,CS-5688,AS-60483,HY-100385,C20563,A873918,Q25323862,(3S,8aS)-3-[(1H-indol-3-yl)methyl]-octahydropyrrolo[1,2-a]piperazine-1,4-dione,(3S,8aS)-3-[(1H-indol-3-yl)methyl]-octahydropyrrolo[1,2-a]pyrazine-1,4-dione,(3S,8aS)-Hexahydro-3-(1H-indol-3-ylmethyl)pyrrolo[1,2-a]pyrazine-1,4-dione,1-Hydroxy-3-[(1H-indol-3-yl)methyl]-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazin-4(3H)-one

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Structure

  • Smiles: C1CC2C(=O)NC(C(=O)N2C1)CC3=CNC4=CC=CC=C43

  • Isomeric smiles: C1C[C@H]2C(=O)N[C@H](C(=O)N2C1)CC3=CNC4=CC=CC=C43

  • Inchi: InChI=1S/C16H17N3O2/c20-15-14-6-3-7-19(14)16(21)13(18-15)8-10-9-17-12-5-2-1-4-11(10)12/h1-2,4-5,9,13-14,17H,3,6-8H2,(H,18,20)/t13-,14-/m0/s1

  • Inchikey: RYFZBPVMVYTEKZ-KBPBESRZSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C16H17N3O2

  • Molecular weight: 283.32

  • Monoisotopic mass: 283.132076794

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