Dataset

Flavone base + 4O, C-(dehydro-dHex)-dHex

Chemical Info

InChI	InChI=1S/C27H28O14/c1-8-20(33)23(36)26(41-27-24(37)22(35)19(32)9(2)39-27)25(38-8)18-14(31)7-16-17(21(18)34)13(30)6-15(40-16)10-3-4-11(28)12(29)5-10/h3-9,19,22-29,31-32,34-37H,1-2H3
SMILES	O=C1C=C(OC2=CC(O)=C(C(O)=C12)C4OC(C(=O)C(O)C4(OC3OC(C)C(O)C(O)C3(O)))C)C=5C=CC(O)=C(O)C=5
InChI Key	GKLSYIMLZDYQBJ-UHFFFAOYSA-N
Molecular Formula	C27H28O14
Exact Mass	576.507 g/mol

Data and Resources

• Flavone base + 4O, C-(dehydro-dHex)-dHexHTML
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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-PR309291
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T20:30:26.624390
MetadataModified	2025-02-09T18:25:32.680941
MetadataPublished	2019-03-28
Related Molecule

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
70065713	NMRShiftDB
70255-49-1	ACToR
HMDB0037419	Human Metabolome Database
194340	PubChem
The data in this table is sourced from UniChem at EBI.