3-O-(beta-D-Glucopyranosyl(1-6)-beta-D-glucopyranosyl(1-4)-alpha-L-rhamnopyranosyl(1-4)-beta-D-xylopyranosyl)-3beta,23-dihydroxy delta(12)-oleanen-28-carboxylic acid
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3-O-(beta-D-Glucopyranosyl(1-6)-beta-D-glucopyranosyl(1-4)-alpha-L-rhamnopyranosyl(1-4)-beta-D-xylopyranosyl)-3beta,23-dihydroxy delta(12)-oleanen-28-carboxylic acid
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CAS No:
155569-77-0
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Formula:
C53H86O22
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Chemical Name:
3-O-(beta-D-Glucopyranosyl(1-6)-beta-D-glucopyranosyl(1-4)-alpha-L-rhamnopyranosyl(1-4)-beta-D-xylopyranosyl)-3beta,23-dihydroxy delta(12)-oleanen-28-carboxylic acid
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Synonyms:
3-O-(beta-D-glucopyranosyl(1-6)-beta-D-glucopyranosyl(1-4)-alpha-L-rhamnopyranosyl(1-4)-beta-D-xylopyranosyl)-3beta,23-dihydroxy delta(12)-oleanen-28-carboxylic acid;transsylvanoside A;155569-77-0;3-O-(beta-D-Glucopyranosyl(1-6)-beta-D-glucopyranosyl(1-4)-alpha-L-rhamnopyranosyl(1-4)-beta-D-xylopyranosyl)-3beta,23-dihydroxy delta(12)-oleanen-28-carboxylic acid;Olean-12-en-28-oic acid, 3-((O-beta-D-glucopyranosyl-(1-6)-O-beta-D-glucopyranosyl-(1-4)-O-6-deoxy-alpha-L-mannopyranosyl-(1-4)-beta-D-xylopyranosyl)oxy)-23-hydroxy-, (3beta,4alpha)-
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CAS No:
3-O-(beta-D-Glucopyranosyl(1-6)-beta-D-glucopyranosyl(1-4)-alpha-L-rhamnopyranosyl(1-4)-beta-D-xylopyranosyl)-3beta,23-dihydroxy delta(12)-oleanen-28-carboxylic acid Basic Attributes
1075.2 g/mol
1074.56107437 g/mol
Drug Information
3-O-(beta-D-glucopyranosyl(1-6)-beta-D-glucopyranosyl(1-4)-alpha-L-rhamnopyranosyl(1-4)-beta-D-xylopyranosyl)-3beta,23-dihydroxy delta(12)-oleanen-28-carboxylic acid
Computed Properties
Molecular Weight:1075.2
XLogP3:-0.1
Hydrogen Bond Donor Count:13
Hydrogen Bond Acceptor Count:22
Rotatable Bond Count:12
Exact Mass:1074.56107437
Monoisotopic Mass:1074.56107437
Topological Polar Surface Area:354
Heavy Atom Count:75
Complexity:2060
Defined Atom Stereocenter Count:28
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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