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isorhamnetin-3-O-rutinoside, Narcissoside,...

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PT204203

Dataset description:

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PT204203 contains the MS2 mass spectrum of isorhamnetin-3-O-rutinoside, Narcissoside,...

Source: isorhamnetin-3-O-rutinoside, Narcissoside, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one, Narcissin, Isorhamnetin-3-rhamnoglucoside , Isor-3-Glc-6pp-Rha

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
SMILES	CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)O)O)O)O)O)O
InChI Key	UIDGLYUNOUKLBM-UHFFFAOYSA-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 4.0 International (CC BY-NC 4.0)
Id	431cb26d-2c3a-43ad-b30f-246e02870b65
Package id	msbnk-riken_respect-pt204203
Resource type	HTML
State	active