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cis-Solamin

Base Information
  • Chemical Name:cis-Solamin
  • CAS No.:158705-59-0
  • Molecular Formula:C35H64O5
  • Molecular Weight:564.89
  • Hs Code.:
  • ChEMBL ID:CHEMBL396297
  • DSSTox Substance ID:DTXSID001105706
  • Nikkaji Number:J2.099.451G
  • Wikidata:Q105233307
  • Mol file:158705-59-0.mol
cis-Solamin

Synonyms:cis-solamin

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Chemical Property of cis-Solamin
Chemical Property:
  • XLogP3:11.8
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:5
  • Rotatable Bond Count:26
  • Exact Mass:564.47537514
  • Heavy Atom Count:40
  • Complexity:662
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CCCCCCCCCCCCC(C1CCC(O1)C(CCCCCCCCCCCCC2=CC(OC2=O)C)O)O
  • Isomeric SMILES:CCCCCCCCCCCC[C@@H]([C@@H]1CC[C@@H](O1)[C@@H](CCCCCCCCCCCCC2=C[C@@H](OC2=O)C)O)O
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