Dataset

Solanidine base + O-Hex-dHex

This MassBank record with Accession MSBNK-RIKEN-PR310700 contains the MS2 mass spectrum of Solanidine base + O-Hex-dHex with the InChIkey ZLSYCIYRYZUJCZ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C39H63NO10/c1-18-6-9-26-19(2)29-27(40(26)16-18)15-25-23-8-7-21-14-22(10-12-38(21,4)24(23)11-13-39(25,29)5)48-37-35(33(45)31(43)28(17-41)49-37)50-36-34(46)32(44)30(42)20(3)47-36/h7,18-20,22-37,41-46H,6,8-17H2,1-5H3
SMILES OCC8OC(OC6CC5=CCC4C(CCC3(C)(C4(CC2N1CC(C)CCC1C(C)C23)))C5(C)CC6)C(OC7OC(C)C(O)C(O)C7(O))C(O)C8(O)
InChI Key ZLSYCIYRYZUJCZ-UHFFFAOYSA-N
Molecular Formula C39H63NO10
Exact Mass 705.930 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-PR310700
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:01:29.379579
MetadataModified 2025-02-09T18:29:52.679723
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
172316 ChEBI
HMDB0030321 Human Metabolome Database
12302820 PubChem
The data in this table is sourced from UniChem at EBI.