Dataset
3c_JCAMP.
Chemical Info
InChI | InChI=1S/C17H30O3/c1-2-3-4-5-6-7-8-9-10-11-14-17(20)15(18)12-13-16(17)19/h12-13,15,18,20H,2-11,14H2,1H3 |
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SMILES | [CH:1]1([OH:7])[C:2]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:17][CH2:18][CH2:19][CH3:20])([OH:16])[C:3](=[O:6])[CH:4]=[CH:5]1 |
InChI Key | LLHNPPQNZJXJID-UHFFFAOYSA-N |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.57992/nmrxiv.p57.s340.d1868 |
License URL | https://creativecommons.org/licenses/by/4.0/legalcode |
Source | https://nmrxiv.org/D1868 |
Version | |
Author | Toni Ditfe, Dr. Eileen Bette, Dr. Haider N. Sultani, Dr. Alexander Otto, Prof. Dr. Ludger A. Wessjohann, Dr. Norbert Arnold, Prof. Dr. Bernhard Westermann |
Maintainer | |
Language | english |
MetadataCreated | 2024-05-15T08:59:46.042974 |
MetadataModified | 2024-09-23T09:37:37.038342 |
MetadataPublished | 2024-01-19 09:20:10 |
Field | Value |
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No additional information available for this Dataset. |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |