Dataset
dhas#18
Chemical Info
InChI | InChI=1S/C17H32O8/c1-10(24-17-15(21)9-14(20)11(2)25-17)7-12(18)5-3-4-6-13(19)8-16(22)23/h10-15,17-21H,3-9H2,1-2H3,(H,22,23)/t10?,11?,12-,13-,14-,15?,17-/m1/s1 |
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SMILES | CC(C[C@H](O)CCCC[C@@H](O)CC(O)=O)O[C@@H]1OC(C)[C@H](O)CC1O |
InChI Key | KOPWGKUEIMDQOP-YSEGPLCXSA-N |
Molecular Formula | C17H32O8 |
Exact Mass | 364.210 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BGC_Munich-RP009611 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T12:26:38.927086 |
MetadataModified | 2025-02-09T08:45:02.045101 |
MetadataPublished | 2017-11-29 |
Related Molecule |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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182840 | ChEBI |
137628431 | PubChem |
The data in this table is sourced from UniChem at EBI. |