esculentoside I
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esculentoside I
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CAS No:
141890-70-2
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Formula:
C49H78O22
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Chemical Name:
esculentoside I
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Synonyms:
3-O-(glucopyranosyl-(1-4)-glucopyranosyl)-28-O-glucopyranosylphytolaccagenin;esculentoside I;Olean-12-ene-28,29-dioic acid, 3-((4-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy)-2,23-dihydroxy-, 28-beta-D-glucopyranosyl 29-methyl ester, (2beta,3beta,4alpha,20beta)-
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CAS No:
Computed Properties
Molecular Weight:1019.1
XLogP3:-1.6
Hydrogen Bond Donor Count:13
Hydrogen Bond Acceptor Count:22
Rotatable Bond Count:13
Exact Mass:1018.49847411
Monoisotopic Mass:1018.49847411
Topological Polar Surface Area:362
Heavy Atom Count:71
Complexity:1980
Defined Atom Stereocenter Count:25
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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