β-D-Glucopyranose, 1-[(4aR,5S,6R,8aS)-5-[2-(2,5-dihydro-5-oxo-3-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-1-naphthalenecarboxylate]
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β-D-Glucopyranose, 1-[(4aR,5S,6R,8aS)-5-[2-(2,5-dihydro-5-oxo-3-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-1-naphthalenecarboxylate]
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CAS No:
51419-52-4
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Formula:
C26H38O9
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Chemical Name:
β-D-Glucopyranose, 1-[(4aR,5S,6R,8aS)-5-[2-(2,5-dihydro-5-oxo-3-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-1-naphthalenecarboxylate]
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Synonyms:
β-D-Glucopyranose,1-[(4aR,5S,6R,8aS)-5-[2-(2,5-dihydro-5-oxo-3-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-1-naphthalenecarboxylate];β-D-Glucopyranose,1-[5-[2-(2,5-dihydro-5-oxo-3-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-1-naphthalenecarboxylate],[4aR-(4aα,5α,6β,8aα)]-;Marrubiaside;Marrubiasid
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CAS No:
β-D-Glucopyranose, 1-[(4aR,5S,6R,8aS)-5-[2-(2,5-dihydro-5-oxo-3-furanyl)ethyl]-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-1-naphthalenecarboxylate] Basic Attributes
494.57452
494.57
Computed Properties
Molecular Weight:494.6
XLogP3:2.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:494.25158279
Monoisotopic Mass:494.25158279
Topological Polar Surface Area:143
Heavy Atom Count:35
Complexity:897
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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