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Kaempferol 3-O-sophoroside

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR303429

Dataset description:

This MassBank record with Accession MSBNK-RIKEN-PR303429 contains the MS2 mass spectrum of Kaempferol 3-O-sophoroside with the InChIkey LKZDFKLGDGSGEO-UJECXLDQSA-N.

Source: Kaempferol 3-O-sophoroside

Chemical Info

molecular Image

InChI	InChI=1S/C27H30O16/c28-7-14-17(33)20(36)22(38)26(40-14)43-25-21(37)18(34)15(8-29)41-27(25)42-24-19(35)16-12(32)5-11(31)6-13(16)39-23(24)9-1-3-10(30)4-2-9/h1-6,14-15,17-18,20-22,25-34,36-38H,7-8H2/t14-,15-,17-,18-,20+,21+,22-,25-,26+,27+/m1/s1
SMILES	OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)[C@H](O)[C@@H](O)[C@@H]1O
InChI Key	LKZDFKLGDGSGEO-UJECXLDQSA-N
Molecular Formula	C27H30O16
Exact Mass	610.521 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	59b43d2a-7258-414b-a449-57d2b6ab0f44
Package id	msbnk-riken-pr303429
Resource type	HTML
State	active