Dataset
Eleutherol
Chemical Info
InChI | InChI=1S/C14H12O4/c1-7-11-9(14(16)18-7)6-8-4-3-5-10(17-2)12(8)13(11)15/h3-7,15H,1-2H3/t7-/m1/s1 |
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SMILES | COc(c3)c(c(cc3)1)c(O)c([C@@H](C)2)c(C(=O)O2)c1 |
InChI Key | KNLHGXVYZRQSJZ-SSDOTTSWSA-N |
Molecular Formula | C14H12O4 |
Exact Mass | 244.074 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-nc/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00607 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T16:35:54.076788 |
MetadataModified | 2024-01-11T16:35:54.245366 |
MetadataPublished | 2016-01-19 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |