Dataset

Strictosamide

This MassBank record with Accession MSBNK-RIKEN-PR309371 contains the MS2 mass spectrum of Strictosamide with the InChIkey LBRPLJCNRZUXLS-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C26H30N2O8/c1-2-12-15-9-18-20-14(13-5-3-4-6-17(13)27-20)7-8-28(18)24(33)16(15)11-34-25(12)36-26-23(32)22(31)21(30)19(10-29)35-26/h2-6,11-12,15,18-19,21-23,25-27,29-32H,1,7-10H2
SMILES O=C5C2=COC(OC1OC(CO)C(O)C(O)C1(O))C(C=C)C2CC6C=4NC=3C=CC=CC=3C=4CCN56
InChI Key LBRPLJCNRZUXLS-UHFFFAOYSA-N
Molecular Formula C26H30N2O8
Exact Mass 498.532 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-PR309371
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T20:42:21.598024
MetadataModified 2024-01-11T20:42:21.744581
MetadataPublished 2019-03-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
60081267 NMRShiftDB
PD158569 ProbesDrugs
5015264 PubChem
210310 Brenda
HMDB0259813 Human Metabolome Database
The data in this table is sourced from UniChem at EBI.