Digitoxigenin-3-beta-L-glucosylglycyl ester

Base Information

• Chemical Name: Digitoxigenin-3-beta-L-glucosylglycyl ester
• CAS No.: 81072-27-7
• Molecular Formula: C31H47NO10
• Molecular Weight: 593.7056

Synonyms:81072-28-8;Digitoxigenin-3-beta-L-glucosylglycyl ester;Digitoxigenin-3-beta-N-D-(+)-glucosylglycyl ester;Glycine, N-D-glucosyl-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide;Glycine, N-L-glucosyl-, 3-ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide;81072-27-7;LS-72663;LS-72664;[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-(2,3,4,5,6-pentahydroxyhexylideneamino)acetate

Chemical Property of Digitoxigenin-3-beta-L-glucosylglycyl ester

Chemical Property:

• Vapor Pressure: 1.21E-33mmHg at 25°C
• Boiling Point: 850.3°Cat760mmHg
• Flash Point: 468.1°C
• Density: 1.49g/cm³
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 10
• Exact Mass: 593.31999670
• Heavy Atom Count: 42
• Complexity: 1100

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Safty Information:

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• Canonical SMILES: CC12CCC(CC1CCC3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C)OC(=O)CN=CC(C(C(C(CO)O)O)O)O

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