Dataset

Malbit, Amalti Syrup, 4-O-alpha-Glucopyranosyl-D-glucitol, (2S,3R,4R,5R)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,5,6-pentol, Maltit, Maltisorb, 4-O-alpha-Glucopyranosyl-D-sorbitol, Maltitol, D-4-O-alpha-D-Glucopyranosylglucitol

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PT205470 contains the MS2 mass spectrum of Malbit, Amalti Syrup, 4-O-alpha-Glucopyranosyl-D-glucitol, (2S,3R,4R,5R)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,5,6-pentol, Maltit, Maltisorb, 4-O-alpha-Glucopyranosyl-D-sorbitol, Maltitol, D-4-O-alpha-D-Glucopyranosylglucitol with the InChIkey VQHSOMBJVWLPSR-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2
SMILES C(C1C(C(C(C(O1)OC(C(CO)O)C(C(CO)O)O)O)O)O)O
InChI Key VQHSOMBJVWLPSR-UHFFFAOYSA-N
Molecular Formula C12H24O11
Exact Mass 344.313 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PT205470
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:06:58.853236
MetadataModified 2024-01-11T21:06:59.020202
MetadataPublished 2008-07-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
3871 PubChem
536616 eMolecules
SCHEMBL433320 SureChEMBL
PD065589 ProbesDrugs
The data in this table is sourced from UniChem at EBI.