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Flavonol base + 4O, 1MeO, O-Hex, O-Hex, O-Hex

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR309266

Dataset description:

This MassBank record with Accession MSBNK-RIKEN-PR309266 contains the MS2 mass spectrum of Flavonol base + 4O, 1MeO, O-Hex, O-Hex, O-Hex with the InChIkey POYUZVAGWZVXKD-UHFFFAOYSA-N.

Source: Flavonol base + 4O, 1MeO, O-Hex, O-Hex, O-Hex

Chemical Info

molecular Image

InChI	InChI=1S/C34H42O23/c1-50-13-2-9(3-14(19(13)39)53-33-28(48)25(45)21(41)16(7-36)55-33)30-31(57-34-29(49)26(46)22(42)17(8-37)56-34)23(43)18-11(38)4-10(5-12(18)52-30)51-32-27(47)24(44)20(40)15(6-35)54-32/h2-5,15-17,20-22,24-29,32-42,44-49H,6-8H2,1H3
SMILES	O=C3C(OC1OC(CO)C(O)C(O)C1(O))=C(OC=4C=C(OC2OC(CO)C(O)C(O)C2(O))C=C(O)C3=4)C=6C=C(OC)C(O)=C(OC5OC(CO)C(O)C(O)C5(O))C=6
InChI Key	POYUZVAGWZVXKD-UHFFFAOYSA-N
Molecular Formula	C34H42O23
Exact Mass	818.687 g/mol

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Additional Information

Field	Value
Data last updated	January 11, 2024
Metadata last updated	January 11, 2024
Created	January 11, 2024
Format	HTML
License	Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
Id	18a23524-3ae1-4518-a431-54482a70c17a
Package id	msbnk-riken-pr309266
Resource type	HTML
State	active