Helicin
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Helicin
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CAS No:
618-65-5
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Formula:
C13H16O7
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Chemical Name:
Helicin
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Synonyms:
Benzaldehyde,2-(β-D-glucopyranosyloxy)-;Helicin;2-(β-D-Glucopyranosyloxy)benzaldehyde;Salicylaldehyde 3-O-acetyl-β-D-glucopyranoside;147590-47-4
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CAS No:
Description
Helicin, found in Rosaceae, is a moderate syrB inducer. Helicon can be hydrolyzed by BglY enzyme[1][2].
Helicin is a beta-D-glucoside resultng from the oxidation of the benzylic hydroxy group of salicin to the corresponding aldehyde. It has a role as a metabolite. It is a member of benzaldehydes, a beta-D-glucoside and a monosaccharide derivative. It derives from a salicylaldehyde and a salicin.
Characteristics
116
-1.5
White to yellow Crystalline Powder
1.5±0.1 g/cm3
175 °C
212.6±23.6 °C
1.651
16.39g/L(cold water)
D20 -60° (c = 1.4)
161.4 Ų [M+Na]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]
Computed Properties
Molecular Weight:284.26
XLogP3:-1.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:284.08960285
Monoisotopic Mass:284.08960285
Topological Polar Surface Area:116
Heavy Atom Count:20
Complexity:324
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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