Dataset

alpha-D-lactobiose, Lac, (Gal(beta1-4)Glc) , alpha-Lactose monohydrate, beta-D-Gal-(1-4)-alpha-D-Glc, Milk sugar, 4-O-beta-D-Galactopyranosyl-alpha-D-glucose

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS037902 contains the MS2 mass spectrum of alpha-D-lactobiose, Lac, (Gal(beta1-4)Glc) , alpha-Lactose monohydrate, beta-D-Gal-(1-4)-alpha-D-Glc, Milk sugar, 4-O-beta-D-Galactopyranosyl-alpha-D-glucose with the InChIkey GUBGYTABKSRVRQ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2
SMILES C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O
InChI Key GUBGYTABKSRVRQ-UHFFFAOYSA-N
Molecular Formula C12H22O11
Exact Mass 342.297 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-PS037902
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:06:48.090667
MetadataModified 2024-01-11T21:06:48.261180
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
294 PubChem
63-42-3 ACToR
528-50-7 ACToR
14641-93-1 ACToR
13360-52-6 ACToR
PD055406 ProbesDrugs
60023341 NMRShiftDB
SCHEMBL24202679 SureChEMBL
590728 eMolecules
5965-66-2 ACToR
6363-53-7 ACToR
69-79-4 ACToR
MCULE-2333127533 Mcule
SCHEMBL684118 SureChEMBL
HMDB0246552 Human Metabolome Database
BLACTO CCDC
SCHEMBL23708014 SureChEMBL
SCHEMBL20276017 SureChEMBL
The data in this table is sourced from UniChem at EBI.