19S-Methoxytubotaiwine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR300023
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR300023 contains the MS2 mass spectrum of 19S-Methoxytubotaiwine with the InChIkey LTOOPESWVADEAE-JHOCLNBPSA-N.
Source: 19S-Methoxytubotaiwine
Chemical Info
InChI | InChI=1S/C21H26N2O3/c1-12(25-2)16-13-8-10-23-11-9-21(19(16)23)14-6-4-5-7-15(14)22-18(21)17(13)20(24)26-3/h4-7,12-13,16,19,22H,8-11H2,1-3H3/t12-,13+,16?,19-,21-/m1/s1 |
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SMILES | CO[C@H](C)C1[C@H]2N3CC[C@@]22C(NC4=CC=CC=C24)=C([C@H]1CC3)C(=O)OC |
InChI Key | LTOOPESWVADEAE-JHOCLNBPSA-N |
Molecular Formula | C21H26N2O3 |
Exact Mass | 354.450 g/mol |
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Additional Information
Field | Value |
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Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
Id | d097f316-24e5-4615-97b7-b34ab79192a5 |
Package id | msbnk-riken-pr300023 |
Resource type | HTML |
State | active |