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Malyngamide H

Base Information
  • Chemical Name:Malyngamide H
  • CAS No.:165337-92-8
  • Molecular Formula:C26H41 N O4
  • Molecular Weight:431.61
  • Hs Code.:
  • DSSTox Substance ID:DTXSID701046105
  • Nikkaji Number:J653.574G
  • Wikidata:Q105168246
  • Metabolomics Workbench ID:100605
  • ChEMBL ID:CHEMBL470136
  • Mol file:165337-92-8.mol
Malyngamide H

Synonyms:malyngamide H

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Chemical Property of Malyngamide H
Chemical Property:
  • PSA:67.93000 
  • LogP:5.59850 
  • XLogP3:5.7
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:16
  • Exact Mass:431.30355879
  • Heavy Atom Count:31
  • Complexity:681
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MSDS Files:
Useful:
  • Chemical Classes:other linear non-peptide (Malyngamide)
  • Canonical SMILES:CCCCCCCC(CC=CCCC(=O)NCCC(=C)C12C(O1)CC=C(C2=O)C)OC
  • Isomeric SMILES:CCCCCCC[C@@H](C/C=C/CCC(=O)NCCC(=C)[C@]12[C@H](O1)CC=C(C2=O)C)OC
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