Scutellarin

enlarge

Systematic / IUPAC Name: 5,6-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl hexopyranosiduronic acid

ID: Reference946

Other Names: β-D-Glucopyranosiduronic acid, 5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl;
Glucopyranosiduronic acid, 5,6-dihydroxy-2-(p-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl, β-D-;
Breviscapine;
Scutellarein-7-glucuronide;
Scutellarein-7β-D-glucuronide ; more

Formula: C21H18O12

Class: Endogenous Metabolites Natural Products/Medicines

Spectral Data

Scutellarin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 75
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 7/30/2014 2:37:32 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)10-5-9(23)13-11(31-10)6-12(14(24)15(13)25)32-21-18(28)16(26)17(27)19(33-21)20(29)30/h1-6,16-19,21-22,24-28H,(H,29,30)/t16-,17-,18+,19-,21+/m0/s1
InChI Key DJSISFGPUUYILV-ZFORQUDYSA-N
Canonical SMILES
CAS 27740018
Splash
Other Names β-D-Glucopyranosiduronic acid, 5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl;
Glucopyranosiduronic acid, 5,6-dihydroxy-2-(p-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl, β-D-;
Breviscapine;
Scutellarein-7-glucuronide;
Scutellarein-7β-D-glucuronide;
Scutellarein-7β-D-glucuronoside;
Scutellarein-7-O-β-D-glucuronide

In Other Databases

ChEBI CHEBI:61278
ChemIDPlus 027740018; 116122362
ChEMBL CHEMBL487805
ChemSpider 161366
PubChem 185617
Wikipedia Scutellarin