Dataset

Amikacin

This MassBank record with Accession MSBNK-Waters-WA000399 contains the MS mass spectrum of Amikacin with the InChIkey LKCWBDHBTVXHDL-RMDFUYIESA-N.

Chemical Info

molecular Image
InChI InChI=1S/C22H43N5O13/c23-2-1-8(29)20(36)27-7-3-6(25)18(39-22-16(34)15(33)13(31)9(4-24)37-22)17(35)19(7)40-21-14(32)11(26)12(30)10(5-28)38-21/h6-19,21-22,28-35H,1-5,23-26H2,(H,27,36)/t6-,7+,8-,9+,10+,11-,12+,13+,14+,15-,16+,17-,18+,19-,21+,22+/m0/s1
SMILES NCCC(O)C(=O)NC(C1)C(OC(O3)C(O)C(N)C(O)C(CO)3)C(O)C(OC(O2)C(O)C(O)C(O)C(CN)2)C(N)1
InChI Key LKCWBDHBTVXHDL-RMDFUYIESA-N
Molecular Formula C22H43N5O13
Exact Mass 585.286 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-Waters-WA000399
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:49:37.997941
MetadataModified 2024-01-11T22:49:38.153616
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
157 DrugCentral
ZINC000008214483 ZINC
10894 Guide to Pharmacology
AMIKACIN DailyMed
AMIKACIN rxnorm
AMIKACIN SULFATE rxnorm
DTXSID3022586 EPA CompTox Dashboard
ARIKAYCE clinicaltrials
AMIKACIN SULFATE clinicaltrials
BB-K8 clinicaltrials
BAY 41-6551 clinicaltrials
AMIKACIN clinicaltrials
AMIKIN clinicaltrials
HMDB0014622 Human Metabolome Database
CB8146049 ChemicalBook
amikacin DailyMed
1394 Brenda
50237603 BindingDB
PA164744372 PharmGKB
37768 PubChem
14886882 PubChem: Thomson Pharma
60058691 NMRShiftDB
PD010002 ProbesDrugs
84319SGC3C FDA SRS
AKN PDBe
SCHEMBL2985 SureChEMBL
37517-28-5 ACToR
108914-65-4 ACToR
LSM-5935 LINCS
GABFOE CCDC
J19.345C Nikkaji
MCULE-6148260173 Mcule
DB00479 DrugBank
CHEMBL177 ChEMBL
2637 ChEBI
C06820 KEGG Ligand
36519241 eMolecules
The data in this table is sourced from UniChem at EBI.