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Scopolin structure, CAS 531-44-2

Scopolin

CAS Number531-44-2

SynonymsScopolin; Scopoletin glucoside; 7-(β-D-glucopyranosoyloxy)-6-methoxy-2H-1-benzopyran-2-one; 7-(b-D-Glucopyranosyloxy)-6-methoxy-2H-1-benzopyran-2-one; Scopoletin 7-O-Glucoside; 6-Methoxy-2-oxo-2H-chromen-7-yl β-D-glucopyranoside; 2'-β-D-glucosyl scopolin; Murrayin; CPD-678; Scopoletin 7-glucoside; 7β-D-Glucopyranosyloxy-6-methoxycoumarin; Scopoline; Scopoloside

Molecular FormulaC16H18O9

Molecular Weight354.31

Purity≥95.0 (HPLC)%

Density1.6±0.1 g/cm3

Boiling Point650.2±55.0 °C at 760 mmHg

Melting Point217ºC

Flash Point

Appearance

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Cat. No.: 2A-9066470 Purity: ≥95.0 (HPLC)%
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Quality Control of [ 531-44-2 ] Purity: ≥95.0 (HPLC)% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number531-44-2
Catalog No.2A-9066470
Chinese Name东莨菪甙； 东莨菪苷
SynonymsScopolin; Scopoletin glucoside; 7-(β-D-glucopyranosoyloxy)-6-methoxy-2H-1-benzopyran-2-one; 7-(b-D-Glucopyranosyloxy)-6-methoxy-2H-1-benzopyran-2-one; Scopoletin 7-O-Glucoside; 6-Methoxy-2-oxo-2H-chromen-7-yl β-D-glucopyranoside; 2'-β-D-glucosyl scopolin; Murrayin; CPD-678; Scopoletin 7-glucoside; 7β-D-Glucopyranosyloxy-6-methoxycoumarin; Scopoline; Scopoloside
Molecular FormulaC16H18O9
Molecular Weight354.31
Purity≥95.0 (HPLC)
Density1.6±0.1 g/cm3
Boiling Point650.2±55.0 °C at 760 mmHg
Melting Point217ºC
Storage Conditionroom temperature
ApplicationScopolin is a coumarin isolated from Arabidopsis (Arabidopsis) roots. Scopolin alleviates hepatic steatosis by activating SIRT1-mediated signaling cascades.
SMILESO1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O)Oc2cc3c(cc2OC)CCC(=O)O3
InChI1S/C16H20O9/c1-22-9-4-7-2-3-12(18)23-8(7)5-10(9)24-16-15(21)14(20)13(19)11(6-17)25-16/h4-5,11,13-17,19-21H,2-3,6H2,1H3/t11-,13-,14+,15-,16-/m1/s1
InChI KeyWSHSQJSPOLYHLM-YMILTQATSA-N
NACRES CodeNA.24
UNSPSC41116107
MSDSmsds/66470_1_531_44_2.pdf
Transport InfoProduct name: Scopolamine
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