Dataset
Humantenine
Chemical Info
InChI | InChI=1S/C21H26N2O3/c1-4-13-11-22(2)18-10-21(19-9-14(13)15(18)12-26-19)16-7-5-6-8-17(16)23(25-3)20(21)24/h4-8,14-15,18-19H,9-12H2,1-3H3 |
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SMILES | CON1C(=O)C2(CC3C4COC2CC4C(CN3C)=CC)C2=CC=CC=C12 |
InChI Key | SJKRPUOXUNOPOP-UHFFFAOYSA-N |
Molecular Formula | C21H26N2O3 |
Exact Mass | 354.450 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-nc-sa/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR304518 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T20:40:06.038520 |
MetadataModified | 2024-01-11T20:40:06.194542 |
MetadataPublished | 2019-03-28 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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181368 | ChEBI |
75055101 | PubChem |
The data in this table is sourced from UniChem at EBI. |