CAS: 20196-67-2 - Sinalbin

Formule : C₁₆H₂₄NO₅·C₁₄H₁₈NO₁₀S₂

InChI : InChI=1S/C16H23NO5.C14H19NO10S2/c1-17(2,3)8-9-22-15(18)7-6-12-10-13(20-4)16(19)14(11-12)21-5;16-6-9-11(18)12(19)13(20)14(24-9)26-10(15-25-27(21,22)23)5-7-1-3-8(17)4-2-7/h6-7,10-11H,8-9H2,1-5H3;1-4,9,11-14,16-20H,5-6H2,(H,21,22,23)/t;9-,11-,12+,13-,14+/m.1/s1

Code InChI : InChIKey=NUXXPTJGCLKPIG-VDHCZMMKSA-N

SMILES : O=C(OCC[N+](C)(C)C)C=CC1=CC(OC)=C(O)C(OC)=C1.O=S(=O)([O-])ON=C(SC1OC(CO)C(O)C(O)C1O)CC2=CC=C(O)C=C2

Synonymes :

• (2-(3-(4-Hydroxy-3,5-dimethoxyphenyl)acryloyloxy)ethyl)trimethylammonium, saltwith 1-thio-beta-D-glucopyranose 1-(4-hydroxy-N-(sulphooxy)phenylacetimidate) (1:1)
• 2-{[3-(4-hydroxy-3,5-dimethoxyphenyl)acryloyl]oxy}-N,N,N-trimethylethanaminium 1-S-[2-(4-hydroxyphenyl)-N-(sulfonatooxy)ethanimidoyl]-1-thio-beta-D-glucopyranose
• Choline, salt with 1-thio-β-<span class="text-smallcaps">D</span>-glucopyranose 1-[2-(p-hydroxyphenyl)acetohydroximate] NO-(hydrogen sulfate) (1:1), mono(4-hydroxy-3,5-dimethoxycinnamate) (ester)
• Ethanaminium, 2-[[3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl]oxy]-N,N,N-trimethyl-, salt with 1-thio-β-<span class="text-smallcaps">D</span>-glucopyranose 1-[4-hydroxy-N-(sulfooxy)benzeneethanimidate] (1:1)
• Glucopyranose, 1-thio-, 1-[2-(p-hydroxyphenyl)acetohydroximate], NO-(hydrogen sulfate) ion(1-), choline, mono(4-hydroxy-3,5-dimethoxycinnamate) ester, β-<span class="text-smallcaps">D</span>-
• Sinalbin
• Sinalbin ion(1-)/sinapine mixt.
• Sinalbin ion/sinapine mixt.
• β-<span class="text-smallcaps">D</span>-Glucopyranose, 1-thio-, 1-[4-hydroxy-N-(sulfooxy)benzeneethanimidate], ion(1-), 2-[[3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propen-1-yl]oxy]-N,N,N-trimethylethanaminium
• β-<span class="text-smallcaps">D</span>-Glucopyranose, 1-thio-, 1-[4-hydroxy-N-(sulfooxy)benzeneethanimidate], ion(1-), 2-[[3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl]oxy]-N,N,N-trimethylethanaminium
• Choline, salt with 1-thio-β-D-glucopyranose 1-[2-(p-hydroxyphenyl)acetohydroximate] NO-(hydrogen sulfate) (1:1), mono(4-hydroxy-3,5-dimethoxycinnamate) (ester)
• β-D-Glucopyranose, 1-thio-, 1-[4-hydroxy-N-(sulfooxy)benzeneethanimidate], ion(1-), 2-[[3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propen-1-yl]oxy]-N,N,N-trimethylethanaminium
• β-D-Glucopyranose, 1-thio-, 1-[4-hydroxy-N-(sulfooxy)benzeneethanimidate], ion(1-), 2-[[3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl]oxy]-N,N,N-trimethylethanaminium
• Glucopyranose, 1-thio-, 1-[2-(p-hydroxyphenyl)acetohydroximate], NO-(hydrogen sulfate) ion(1-), choline, mono(4-hydroxy-3,5-dimethoxycinnamate) ester, β-D-

Sinalbin

CAS : 20196-67-2

Sinalbin is a phenolic compound that is found in the seeds of the Senna siamea …

• Formule : C₁₆H₂₄NO₅·C₁₄H₁₈NO₁₀S₂
• Degré de pureté : Min. 95%
• Couleur et forme : Solid
• Masse moléculaire : 734.79 g/mol