Dataset

N-ACETYLMANNOSAMINE

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P101906_EF88 contains the MS2 mass spectrum of N-ACETYLMANNOSAMINE with the InChIkey OVRNDRQMDRJTHS-OZRXBMAMSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5+,6-,7-,8-/m1/s1
SMILES [H][C@@]1(O)O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1NC(C)=O
InChI Key OVRNDRQMDRJTHS-OZRXBMAMSA-N
Molecular Formula C8H15NO6
Exact Mass 221.090 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P101906_EF88
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:35:11.194656
MetadataModified 2025-02-08T18:47:29.851286
MetadataPublished 2021-12-14
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
HY-W040154 MedChemExpress
BM7 PDBe
NACMAN CCDC
J421.873F Nikkaji
ZINC000004228290 ZINC
DTXSID20884420 EPA CompTox Dashboard
MTBLC63154 Metabolights
HMDB0001129 Human Metabolome Database
88J1ZMR63L FDA SRS
11096158 PubChem
PD020143 ProbesDrugs
63154 ChEBI
16167997 PubChem: Thomson Pharma
SCHEMBL140290 SureChEMBL
30487749 eMolecules
The data in this table is sourced from UniChem at EBI.