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

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR309256

Dataset description:

This MassBank record with Accession MSBNK-RIKEN-PR309256 contains the MS2 mass spectrum of Flavonol base + 4O, 1MeO, O-Hex-Hex with the InChIkey WRDDFOFFQDOVRV-UHFFFAOYSA-N.

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

Chemical Info

molecular Image

InChI	InChI=1S/C28H32O18/c1-41-25-11(32)5-12-15(18(25)35)19(36)26(24(43-12)8-2-3-9(30)10(31)4-8)46-28-23(40)21(38)17(34)14(45-28)7-42-27-22(39)20(37)16(33)13(6-29)44-27/h2-5,13-14,16-17,20-23,27-35,37-40H,6-7H2,1H3
SMILES	O=C3C(OC2OC(COC1OC(CO)C(O)C(O)C1(O))C(O)C(O)C2(O))=C(OC=4C=C(O)C(OC)=C(O)C3=4)C=5C=CC(O)=C(O)C=5
InChI Key	WRDDFOFFQDOVRV-UHFFFAOYSA-N
Molecular Formula	C28H32O18
Exact Mass	656.546 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	92baa0fb-4bd9-4f5b-a503-4a1a96b53bb7
Package id	msbnk-riken-pr309256
Resource type	HTML
State	active