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Rhizonin b

  • Formula: C41H63N7O9

  • Molecular weight: 798.00

  • Smiles: CC1C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)N1C)CC(C)C)CC2=COC=C2)C)C(C)C)C(C)C)C(C)C)CC3=COC=C3)C

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Rhizonin b

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

  • Mycotoxin name: Rhizonin b

  • First synonym: Rhizonin b

  • Synonyms: Rhizonin B,85875-25-8

Identifiers / External links

Structure

  • Smiles: CC1C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)N1C)CC(C)C)CC2=COC=C2)C)C(C)C)C(C)C)C(C)C)CC3=COC=C3)C

  • Isomeric smiles: C[C@H]1C(=O)N([C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N1C)CC(C)C)CC2=COC=C2)C)C(C)C)C(C)C)C(C)C)CC3=COC=C3)C

  • Inchi: InChI=1S/C41H63N7O9/c1-22(2)17-29-40(54)46(10)26(9)39(53)47(11)31(19-28-14-16-57-21-28)36(50)43-32(23(3)4)37(51)44-33(24(5)6)38(52)45-34(25(7)8)41(55)48(12)30(35(49)42-29)18-27-13-15-56-20-27/h13-16,20-26,29-34H,17-19H2,1-12H3,(H,42,49)(H,43,50)(H,44,51)(H,45,52)/t26-,29-,30-,31+,32+,33+,34-/m0/s1

  • Inchikey: KYPFAYLQBMKQJL-NJFPPMFVSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C41H63N7O9

  • Molecular weight: 798.00

  • Monoisotopic mass: 797.46872661

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