Dataset

Solanidine base + O-Hex-Hex

Chemical Info

InChI	InChI=1S/C39H63NO11/c1-18-5-8-25-19(2)29-26(40(25)15-18)14-24-22-7-6-20-13-21(9-11-38(20,3)23(22)10-12-39(24,29)4)48-37-34(47)35(31(44)28(17-42)50-37)51-36-33(46)32(45)30(43)27(16-41)49-36/h6,18-19,21-37,41-47H,5,7-17H2,1-4H3
SMILES	OCC8OC(OC7C(O)C(OC6CC5=CCC4C(CCC3(C)(C4(CC2N1CC(C)CCC1C(C)C23)))C5(C)CC6)OC(CO)C7(O))C(O)C(O)C8(O)
InChI Key	OCVQAFQRXHOFMV-UHFFFAOYSA-N
Molecular Formula	C39H63NO11
Exact Mass	721.929 g/mol

Data and Resources

• Solanidine base + O-Hex-HexHTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR310701
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T20:41:58.763169
MetadataModified	2024-01-11T20:41:58.974016
MetadataPublished	2019-03-28

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
HMDB0033696	Human Metabolome Database
75114729	PubChem
The data in this table is sourced from UniChem at EBI.