Dataset

2',6'-Dihydroxy-4-methoxychalcone-4'-O-neohesperid

This MassBank record with Accession MSBNK-RIKEN-PR305678 contains the MS2 mass spectrum of 2',6'-Dihydroxy-4-methoxychalcone-4'-O-neohesperid with the InChIkey HWRDCYOHJBCWGW-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C28H34O14/c1-12-21(33)23(35)25(37)27(39-12)42-26-24(36)22(34)19(11-29)41-28(26)40-15-9-17(31)20(18(32)10-15)16(30)8-5-13-3-6-14(38-2)7-4-13/h3-10,12,19,21-29,31-37H,11H2,1-2H3
SMILES COC1=CC=C(C=CC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O)C=C1
InChI Key HWRDCYOHJBCWGW-UHFFFAOYSA-N
Molecular Formula C28H34O14
Exact Mass 594.566 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR305678
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:39:31.358087
MetadataModified 2025-02-09T17:44:39.751434
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
74259754 PubChem
The data in this table is sourced from UniChem at EBI.