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Paecilodepsipeptide c

  • Formula: C41H51N5O10

  • Molecular weight: 773.90

  • Smiles: CC(C(=O)NC(CC1=CC=C(C=C1)OCC=C(C)C)C(=O)OC)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)CNC(=O)C(C)NC(=O)C(CC3=CC=CC=C3)O

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Paecilodepsipeptide c

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

Names

  • Mycotoxin name: Paecilodepsipeptide c

  • First synonym: Paecilodepsipeptide c

  • Synonyms: paecilodepsipeptide C,CHEMBL224443

Identifiers / External links

Structure

  • Smiles: CC(C(=O)NC(CC1=CC=C(C=C1)OCC=C(C)C)C(=O)OC)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)CNC(=O)C(C)NC(=O)C(CC3=CC=CC=C3)O

  • Isomeric smiles: C[C@H](C(=O)N[C@H](CC1=CC=C(C=C1)OCC=C(C)C)C(=O)OC)NC(=O)[C@@H](CC2=CC=C(C=C2)O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC3=CC=CC=C3)O

  • Inchi: InChI=1S/C41H51N5O10/c1-25(2)19-20-56-32-17-13-30(14-18-32)22-34(41(54)55-5)46-38(51)27(4)43-39(52)33(21-29-11-15-31(47)16-12-29)45-36(49)24-42-37(50)26(3)44-40(53)35(48)23-28-9-7-6-8-10-28/h6-19,26-27,33-35,47-48H,20-24H2,1-5H3,(H,42,50)(H,43,52)(H,44,53)(H,45,49)(H,46,51)/t26-,27+,33+,34+,35-/m0/s1

  • Inchikey: BRNVVRZOPMOJBI-ZIOXGVOXSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C41H51N5O10

  • Molecular weight: 773.90

  • Monoisotopic mass: 773.36359284

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