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isorhamnetin-3-O-galactoside-6''-rhamnoside

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR303258

Dataset description:

This MassBank record with Accession MSBNK-RIKEN-PR303258 contains the MS2 mass spectrum of isorhamnetin-3-O-galactoside-6''-rhamnoside with the InChIkey UIDGLYUNOUKLBM-ZLADREHTSA-N.

Source: isorhamnetin-3-O-galactoside-6''-rhamnoside

Chemical Info

molecular Image

InChI	InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(41-9)40-8-16-19(33)22(36)24(38)28(43-16)44-26-20(34)17-13(31)6-11(29)7-15(17)42-25(26)10-3-4-12(30)14(5-10)39-2/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19-,21+,22-,23+,24+,27+,28-/m0/s1
SMILES	COC1=C(O)C=CC(=C1)C1=C(O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)C(=O)C2=C(O)C=C(O)C=C2O1
InChI Key	UIDGLYUNOUKLBM-ZLADREHTSA-N
Molecular Formula	C28H32O16
Exact Mass	624.548 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	9c0739e3-0db0-48bc-9eff-a165d39384b9
Package id	msbnk-riken-pr303258
Resource type	HTML
State	active