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Azukisaponin IV

Base Information
  • Chemical Name:Azukisaponin IV
  • CAS No.:82793-04-2
  • Molecular Formula:C48H76O20
  • Molecular Weight:973.119
  • Hs Code.:
  • Wikidata:Q105250806
Azukisaponin IV

Synonyms:Azukisaponin IV;CHEBI:184962;4,6a,6b,11,11,14b-hexamethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-8a-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid;4,6a,6b,11,11,14b-Hexamethyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-8a-({[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-4-carboxylic acid

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Chemical Property of Azukisaponin IV
Chemical Property:
  • PSA:332.28000 
  • LogP:-0.79480 
  • XLogP3:0.6
  • Hydrogen Bond Donor Count:12
  • Hydrogen Bond Acceptor Count:20
  • Rotatable Bond Count:11
  • Exact Mass:972.49299481
  • Heavy Atom Count:68
  • Complexity:1900
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C(=O)O)OC6C(C(C(C(O6)CO)O)O)O)C)C)C2C1)C)C(=O)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C
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