β-Hederin
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β-Hederin
structure -
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CAS No:
35790-95-5
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Formula:
C41H66O11
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Chemical Name:
β-Hederin
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Synonyms:
Olean-12-en-28-oic acid,3-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-,(3β)-;(3β)-3-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]olean-12-en-28-oic acid;β-Hederin;Eleutheroside K;Prosapogenin CP2;Tauroside C;Glycoside L-C;Oleanoic acid 3-O-L-rhamnopyranosyl(1→2)-α-L-arabinopyranoside;Eleatheroside K;3β-[(O-α-L-Rhamnopyranosyl-(1→2)-α-L-arabinopyranosyl)oxy]olean-12-en-28-oic acid;Oleanolic acid 3-O-α-L-rhamnopyranosyl-(1→2)-α-L-arabinopyranoside;Pulchinenoside B11;29613-08-9
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CAS No:
Characteristics
175.37000
9.96
1.3±0.1 g/cm3
221-223 °C @ Solvent: Methanol
817.8±65.0 °C at 760 mmHg
240.5±27.8 °C
1.592
Drug Information
(3beta)-3-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-L-arabinopyranosyl)oxy)olean-12-en-28-oic acid
Computed Properties
Molecular Weight:735.0
XLogP3:4.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:734.46051292
Monoisotopic Mass:734.46051292
Topological Polar Surface Area:175
Heavy Atom Count:52
Complexity:1410
Defined Atom Stereocenter Count:17
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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