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D-(+)-Melezitose

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR100777

Dataset description:

This MassBank record with Accession MSBNK-RIKEN-PR100777 contains the MS2 mass spectrum of D-(+)-Melezitose with the InChIkey QWIZNVHXZXRPDR-WSCXOGSTSA-N.

Source: D-(+)-Melezitose

Chemical Info

molecular Image

InChI	InChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-15-10(25)7(3-21)33-18(15,4-22)34-17-14(29)12(27)9(24)6(2-20)31-17/h5-17,19-29H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16-,17-,18+/m1/s1
SMILES	OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@@H]([C@H](O)3)[C@@](CO)(O[C@H](CO)3)O[C@@H](O2)[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)2
InChI Key	QWIZNVHXZXRPDR-WSCXOGSTSA-N
Molecular Formula	C18H32O16
Exact Mass	504.169 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-ShareAlike 4.0 International (CC BY-SA 4.0)
Id	357391a0-878c-4d39-9e0a-ac77e65650ee
Package id	msbnk-riken-pr100777
Resource type	HTML
State	active