Dataset

Ginsenoside compound K

This MassBank record with Accession MSBNK-RIKEN-PR308661 contains the MS2 mass spectrum of Ginsenoside compound K with the InChIkey FVIZARNDLVOMSU-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C36H62O8/c1-20(2)10-9-14-36(8,44-31-30(42)29(41)28(40)23(19-37)43-31)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(39)32(3,4)24(33)12-17-34(25,35)6/h10,21-31,37-42H,9,11-19H2,1-8H3
SMILES CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3CCC21C
InChI Key FVIZARNDLVOMSU-UHFFFAOYSA-N
Molecular Formula C36H62O8
Exact Mass 622.884 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-PR308661
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T19:27:54.203156
MetadataModified 2025-02-09T18:26:48.461169
MetadataPublished 2019-03-28
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
15574829 PubChem
JEPJEU CCDC
HMDB0252724 Human Metabolome Database
70123232 NMRShiftDB
PD065212 ProbesDrugs
The data in this table is sourced from UniChem at EBI.