2alpha,3beta,19-Trihydroxy-28-(beta-D-glucopyranosyloxy)-28-oxours-12-en-23-al
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2alpha,3beta,19-Trihydroxy-28-(beta-D-glucopyranosyloxy)-28-oxours-12-en-23-al
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CAS No:
158848-20-5
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Formula:
C36H56O11
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Chemical Name:
2alpha,3beta,19-Trihydroxy-28-(beta-D-glucopyranosyloxy)-28-oxours-12-en-23-al
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Synonyms:
glucosyl 23-formyl-2,3,19-trihydroxyurs-12-en-28-oate;pinfaensin;Pinfaensin;158848-20-5;DTXSID90936006;Glucosyl 23-formyl-2,3,19-trihydroxyurs-12-en-28-oate;1-O-(2,3,19-Trihydroxy-23,28-dioxours-12-en-28-yl)hexopyranose;2alpha,3beta,19-Trihydroxy-28-(beta-D-glucopyranosyloxy)-28-oxours-12-en-23-al;Urs-12-en-28-oic acid, 2,3,19-trihydroxy-23-oxo-, beta-D-glucopyranosyl ester, (2alpha,3beta,4alpha)-
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CAS No:
2alpha,3beta,19-Trihydroxy-28-(beta-D-glucopyranosyloxy)-28-oxours-12-en-23-al Basic Attributes
664.8 g/mol
664.38226260 g/mol
Computed Properties
Molecular Weight:664.8
XLogP3:2.3
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:664.38226260
Monoisotopic Mass:664.38226260
Topological Polar Surface Area:194
Heavy Atom Count:47
Complexity:1310
Defined Atom Stereocenter Count:17
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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