Buddlejasaponin IV
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Buddlejasaponin IV
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CAS No:
139523-30-1
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Formula:
C48H78O18
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Chemical Name:
Buddlejasaponin IV
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Synonyms:
β-D-Galactopyranoside,(3β,4α,16β)-13,28-epoxy-16,23-dihydroxyolean-11-en-3-yl O-β-D-glucopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-6-deoxy-;(3β,4α,16β)-13,28-Epoxy-16,23-dihydroxyolean-11-en-3-yl O-β-D-glucopyranosyl-(1→2)-O-[β-D-glucopyranosyl-(1→3)]-6-deoxy-β-D-galactopyranoside;Buddlejasaponin IV;Saikosaponin 1;Buddleoglucoside IV
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CAS No:
Computed Properties
Molecular Weight:943.1
XLogP3:0.9
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:9
Exact Mass:942.51881563
Monoisotopic Mass:942.51881563
Topological Polar Surface Area:287
Heavy Atom Count:66
Complexity:1810
Defined Atom Stereocenter Count:26
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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