Kaempferol-3-O-β-glucopyranosyl-7-O-α-rhamnopyranoside

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Systematic / IUPAC Name: 5-Hydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one

ID: Reference8176

Other Names: Kaempferol 3-O-β-D-glucopyranosyl-7-O-α-L-rhamnopyranoside;
7-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl β-D-glucopyranoside

Formula: C27H30O15

Spectral Data

Kaempferol-3-O-β-glucopyranosyl-7-O-α-rhamnopyranoside mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 155
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 8/24/2018 7:59:55 AM
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Identificators

InChI InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(38-9)39-12-6-13(30)16-14(7-12)40-24(10-2-4-11(29)5-3-10)25(19(16)33)42-27-23(37)21(35)18(32)15(8-28)41-27/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26-,27-/m0/s1
InChI Key JYXSWDCPHRTYGU-RVCYDTIBSA-N
Canonical SMILES CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)OC4C(C(C(C(O4)CO)O)O)O)C5=CC=C(C=C5)O)O)O)O)O
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Other Names Kaempferol 3-O-β-D-glucopyranosyl-7-O-α-L-rhamnopyranoside;
7-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl β-D-glucopyranoside

In Other Databases

PubChem 21606527
ChEMBL CHEMBL1929193
ChemSpider 10242552
ChEBI CHEBI:68882