(3β)-3-[(2-O-β-D-Glucopyranosyl-β-D-xylopyranosyl)oxy]olean-12-en-28-oic acid
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![(3β)-3-[(2-O-β-D-Glucopyranosyl-β-D-xylopyranosyl)oxy]olean-12-en-28-oic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ca10e0e6280e48e9ababfe9a4e43e074.png "(3β)-3-[(2-O-β-D-Glucopyranosyl-β-D-xylopyranosyl)oxy]olean-12-en-28-oic acid")
(3β)-3-[(2-O-β-D-Glucopyranosyl-β-D-xylopyranosyl)oxy]olean-12-en-28-oic acid
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CAS No:
117585-05-4
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Formula:
C41H66O12
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Chemical Name:
(3β)-3-[(2-O-β-D-Glucopyranosyl-β-D-xylopyranosyl)oxy]olean-12-en-28-oic acid
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Synonyms:
Olean-12-en-28-oic acid,3-[(2-O-β-D-glucopyranosyl-β-D-xylopyranosyl)oxy]-,(3β)-;(3β)-3-[(2-O-β-D-Glucopyranosyl-β-D-xylopyranosyl)oxy]olean-12-en-28-oic acid;Flaccidin B;Flaccidoside I;3β-Hydroxyolean-12-en-28-oic acid 3-O-β-D-glucopyranosyl-(1→2)-β-D-xylopyranoside
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CAS No:
(3β)-3-[(2-O-β-D-Glucopyranosyl-β-D-xylopyranosyl)oxy]olean-12-en-28-oic acid Basic Attributes
748.9 g/mol
750.96
DTXSID00331669
Computed Properties
Molecular Weight:748.9
XLogP3:4.8
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:6
Exact Mass:748.43977747
Monoisotopic Mass:748.43977747
Topological Polar Surface Area:192
Heavy Atom Count:53
Complexity:1480
Defined Atom Stereocenter Count:16
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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