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Alanine, N-(6-deoxy-L-mannosyl)-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide, L-

Base Information
  • Chemical Name:Alanine, N-(6-deoxy-L-mannosyl)-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide, L-
  • CAS No.:81072-30-2
  • Molecular Formula:C32H49NO9
  • Molecular Weight:591.7328
  • Hs Code.:
  • Mol file:81072-30-2.mol
Alanine, N-(6-deoxy-L-mannosyl)-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide, L-

Synonyms:81072-30-2;Alanine, N-(6-deoxy-L-mannosyl)-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide, L-;Digitoxigenin-3-beta-N-D-(6-deoxy-L-mannosyl)alanyl ester;Digitoxigenin-3-beta-N-L-(6-deoxy-L-mannosyl)alanyl ester;Alanine, N-(6-deoxy-L-mannosyl)-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide, D-;Digitoxigenin 3beta-N-D-(6-deoxy-L-mannosyl)alanyl ester;81176-34-3;LS-15995;LS-15996;[14-Hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]2-(2,3,4,5-tetrahydroxyhexylideneamino)propanoate

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Chemical Property of Alanine, N-(6-deoxy-L-mannosyl)-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide, L-
Chemical Property:
  • Vapor Pressure:8.78E-30mmHg at 25°C 
  • Boiling Point:802.4°Cat760mmHg 
  • Flash Point:439.1°C 
  • PSA:166.11000 
  • Density:1.42g/cm3 
  • LogP:2.07800 
  • XLogP3:1.3
  • Hydrogen Bond Donor Count:5
  • Hydrogen Bond Acceptor Count:10
  • Rotatable Bond Count:9
  • Exact Mass:591.34073214
  • Heavy Atom Count:42
  • Complexity:1110
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC(C(C(C(C=NC(C)C(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C)C)O)O)O)O
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