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
HMDB0014622 Human Metabolome Database
CB8146049 ChemicalBook
PA164744372 PharmGKB
1394 Brenda
50237603 BindingDB
amikacin DailyMed
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
MCULE-6148260173 Mcule
37768 PubChem
36519241 eMolecules
10894 Guide to Pharmacology
AMIKACIN DailyMed
AMIKACIN rxnorm
AMIKACIN SULFATE rxnorm
BAY 41-6551 clinicaltrials
AMIKACIN clinicaltrials
AMIKIN clinicaltrials
ARIKAYCE clinicaltrials
AMIKACIN SULFATE clinicaltrials
BB-K8 clinicaltrials
DTXSID3022586 EPA CompTox Dashboard
157 DrugCentral
ZINC000008214483 ZINC
J19.345C Nikkaji
GABFOE CCDC
DB00479 DrugBank
CHEMBL177 ChEMBL
2637 ChEBI
C06820 KEGG Ligand
The data in this table is sourced from UniChem at EBI.