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theonellapeptolide Ie


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  • Norine ID: NOR00499
  • DOI: 10.26097/nor00499
  • Family: theonellapeptolide
  • Synonym(s): theonellapeptolide Ie;
  • Activity: toxin
  • Class: peptide
  • Formula: C71H127N13O16
  • Monoisotopic mass: 1417.952375081 g/mol
  • Source: norine
  • Contributor (creation): Norine Team [CRIStAL (UMR CNRS 9189), ex-LIFL, France, Charles Viollette Institute, ProBioGEM team, Lille, France, University of Lille, France]
  • Entry information:
  • Type: partial cyclic
  • Number of monomers: 13
  • Smiles: CCC(C)C1NC(=O)CCNC(=O)C(C(C)CC)N(C)C(=O)C(CC(C)C)NC(=O)CCN(C)C(=O)C(NC(=O)C(CC(C)C)N(C)C(=O)C(NC(=O)COC)C(C)C)C(C)OC(=O)C(C(C)CC)N(C)C(=O)C(CC(C)C)NC(=O)CCNC(=O)C(C)N(C)C(=O)C(C(C)C)N(C)C1(=O)

  • Graph inference:



  • Monomeric composition :
    1
    NOMe-Ac-Val
    2
    D-NMe-Leu
    3
    Thr
    4
    NMe-bAla
    5
    D-Leu
    6
    NMe-Ile
    7
    bAla
    8
    D-aIle
    9
    NMe-Val
    10
    NMe-Ala
    11
    bAla
    12
    D-Leu
    13
    D-NMe-aIle
  • Graph representation: NOMe-Ac-Val,D-NMe-Leu,Thr,NMe-bAla,D-Leu,NMe-Ile,bAla,D-aIle,NMe-Val,NMe-Ala,bAla,D-Leu,D-NMe-aIle @1 @0,2 @1,3,12 @2,4 @3,5 @4,6 @5,7 @6,8 @7,9 @8,10 @9,11 @10,12 @2,11

  • Atomic structure:
  • Chemical structure
    rBAN vizualisation:
  • Theonella swinhoei
  • taxid: 37505 (view NCBI taxonomy browser)

  • Links between organisms producing the theonellapeptolide Ie: Theonella swinhoei


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