Dataset

Kaem-3-Rha-7-Rha, Kaempferol-3-Rhamnoside-7-Rhamnoside, Kaempferitrin

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS093606 contains the MS2 mass spectrum of Kaem-3-Rha-7-Rha, Kaempferol-3-Rhamnoside-7-Rhamnoside, Kaempferitrin with the InChIkey PUPKKEQDLNREIM-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3
SMILES CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)OC4C(C(C(C(O4)C)O)O)O)C5=CC=C(C=C5)O)O)O)O)O
InChI Key PUPKKEQDLNREIM-UHFFFAOYSA-N
Molecular Formula C27H30O14
Exact Mass 578.523 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS093606
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:06:47.264747
MetadataModified 2024-01-11T21:06:47.426948
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
60022299 NMRShiftDB
PD056586 ProbesDrugs
57582355 PubChem: Thomson Pharma
12305415 PubChem
The data in this table is sourced from UniChem at EBI.