Dataset

Syrosingopine

This MassBank record with Accession MSBNK-RIKEN-PR305183 contains the MS2 mass spectrum of Syrosingopine with the InChIkey ZCDNRPPFBQDQHR-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C35H42N2O11/c1-7-46-35(40)48-31-26(42-3)12-18(13-27(31)43-4)33(38)47-28-14-19-17-37-11-10-22-21-9-8-20(41-2)15-24(21)36-30(22)25(37)16-23(19)29(32(28)44-5)34(39)45-6/h8-9,12-13,15,19,23,25,28-29,32,36H,7,10-11,14,16-17H2,1-6H3
SMILES CCOC(=O)OC1=C(OC)C=C(C=C1OC)C(=O)OC1CC2CN3CCC4=C(NC5=C4C=CC(OC)=C5)C3CC2C(C1OC)C(=O)OC
InChI Key ZCDNRPPFBQDQHR-UHFFFAOYSA-N
Molecular Formula C35H42N2O11
Exact Mass 666.724 g/mol

Data and Resources

Metadata Information

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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-PR305183
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MetadataCreated 2024-01-11T20:14:50.155119
MetadataModified 2025-02-09T18:33:43.973150
MetadataPublished 2019-03-28
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