Dataset
1H--1H correlation spectroscopy (1H-1H COSY)
Chemical Info
InChI | InChI=1S/C26H34O11/c1-6-13-33-26-25(35-18(4)29)24(34-17(3)28)23(37-22(30)12-7-16(2)27)21(36-26)15-32-14-19-8-10-20(31-5)11-9-19/h6,8-11,21,23-26H,1,7,12-15H2,2-5H3/t21-,23-,24+,25-,26-/m1/s1 |
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SMILES | C=CCO[C@@H]1O[C@H](COCc2ccc(cc2)OC)[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC(=O)CCC(=O)C |
InChI Key | GQKJGJKLYRNJIU-XDXGNBCUSA-N |
Molecular Formula | C26H34O11 |
Exact Mass | 522.542 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/GQKJGJKLYRNJIU-XDXGNBCUSA-N/NMR/HHCOSY/CDCl3 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/GQKJGJKLYRNJIU-XDXGNBCUSA-N/NMR/HHCOSY/CDCl3 |
Version | |
Author | Marco Mende |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T00:00:51.646963 |
MetadataModified | 2024-09-07T13:27:23.144481 |
MetadataPublished | 2014-05-27 |
Field | Value |
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Measurement Technique | 1H–1H correlation spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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73427501 | PubChem |
The data in this table is sourced from UniChem at EBI. |