Dataset

L-Aad, L-Homoglutamic acid, L-2-Aminoadipic Acid , L-2-Aminohexanedioate, (2S)-2-aminohexanedioic acid, L-alpha-Aminoadipic Acid, L-Ho-Glu, (S)-2-Aminohexanedioic acid, L-2-Aminoadipate

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PT206380 contains the MS2 mass spectrum of L-Aad, L-Homoglutamic acid, L-2-Aminoadipic Acid , L-2-Aminohexanedioate, (2S)-2-aminohexanedioic acid, L-alpha-Aminoadipic Acid, L-Ho-Glu, (S)-2-Aminohexanedioic acid, L-2-Aminoadipate with the InChIkey OYIFNHCXNCRBQI-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C6H11NO4/c7-4(6(10)11)2-1-3-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11)
SMILES C(CC(C(=O)O)N)CC(=O)O
InChI Key OYIFNHCXNCRBQI-UHFFFAOYSA-N
Molecular Formula C6H11NO4
Exact Mass 161.157 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-PT206380
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:07:29.131520
MetadataModified 2024-01-11T21:07:29.289457
MetadataPublished 2008-07-28
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL433238 ChEMBL
37024 ChEBI
HMDB0302754 Human Metabolome Database
MCULE-7434229402 Mcule
10016974 NMRShiftDB
SCHEMBL41328 SureChEMBL
J38.125J Nikkaji
59366488 PubChem
469 PubChem
244390 Brenda
PD093525 ProbesDrugs
HY-113328 MedChemExpress
LMFA01170098 LipidMaps
1K7B1OED4N FDA SRS
113344 Brenda
43091 Brenda
5931 Brenda
11772 Brenda
15194877 PubChem: Thomson Pharma
533723 eMolecules
96433 Brenda
3176 Brenda
CB0499066 ChemicalBook
DTXSID90862154 EPA CompTox Dashboard
MTBLC37024 Metabolights
77421 Brenda
32750 Brenda
The data in this table is sourced from UniChem at EBI.