β-D-Glucopyranosyl (3β)-3-[(3-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
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β-D-Glucopyranosyl (3β)-3-[(3-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
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CAS No:
110219-89-1
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Formula:
C48H78O18
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Chemical Name:
β-D-Glucopyranosyl (3β)-3-[(3-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate
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Synonyms:
Olean-12-en-28-oic acid,3-[(3-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]-,β-D-glucopyranosyl ester,(3β)-;β-D-Glucopyranosyl (3β)-3-[(3-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate;Arvensoside A
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CAS No:
β-D-Glucopyranosyl (3β)-3-[(3-O-β-D-galactopyranosyl-β-D-glucopyranosyl)oxy]olean-12-en-28-oate Basic Attributes
943.1 g/mol
943.12
DTXSID80331662
Computed Properties
Molecular Weight:943.1
XLogP3:2.5
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:10
Exact Mass:942.51881563
Monoisotopic Mass:942.51881563
Topological Polar Surface Area:295
Heavy Atom Count:66
Complexity:1800
Defined Atom Stereocenter Count:23
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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