Dataset
Matrine; LC-ESI-QTOF; MS2
Chemical Information
| InChI | InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-/m0/s1 |
|---|---|
| SMILES | O=C1CCC[C@@H]2[C@H]3CCCN4CCC[C@@H](CN12)[C@@H]34 |
| InChI Key | ZSBXGIUJOOQZMP-JLNYLFASSA-N |
| Molecular Formula | C15H24N2O |
| Exact Mass | 248.370 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-PR301320 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2019-03-28 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEBI:6700 | chebi |
| CHEMBL204860 | chembl |
| 177907 | surechembl |
| 91466 | pubchem |
| N390W430AC | fdasrs |
| PD012041 | probes_and_drugs |
| MATINA | CCDC |
| Molport-002-517-366 | molport |
| 50249581 | bindingdb |
| The data in this table is sourced from UniChem at EBI. | |