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Eriodictyol-7-neohesperidoside

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003516

Dataset description:

This MassBank record with Accession MSBNK-BS-BS003516 contains the MS2 mass spectrum of Eriodictyol-7-neohesperidoside with the InChIkey OBKKEZLIABHSGY-DOYQYKRZSA-N.

Source: Eriodictyol-7-neohesperidoside

Chemical Info

molecular Image

InChI	InChI=1S/C27H32O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-6,9,16,18,20-31,33-37H,7-8H2,1H3/t9-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1
SMILES	C(C1(C(C(C(C(O1)(OC2(C(C(C(OC2(OC3=C(C(=C4C(=O)C(C(OC4=C3[H])(C5=C(C(=C(C(=C5[H])[H])O[H])O[H])[H])[H])([H])[H])O[H])[H])[H])(C(O[H])([H])[H])[H])(O[H])[H])(O[H])[H])[H])[H])(O[H])[H])(O[H])[H])(O[H])[H])[H])([H])([H])[H]
InChI Key	OBKKEZLIABHSGY-DOYQYKRZSA-N
Molecular Formula	C27H32O15
Exact Mass	596.174 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	265a7f78-3e35-46f6-9bed-96d42dc65daa
Package id	msbnk-bs-bs003516
Resource type	HTML
State	active