bis[(5R)-5-amino-4,8-dioxo-1,3,2-dioxalumocan-2-yl] (2S)-2-aminopentanedioate
PubChem CID
129773928
Structure
Molecular Formula
Synonyms
aluminum l-glutamate
Molecular Weight
489.30 g/mol
Computed by PubChem 2.1 (PubChem release 2021.05.07)
Dates
- Create:2017-09-13
- Modify:2025-01-11
Description
A non-essential amino acid naturally occurring in the L-form. Glutamic acid is the most common excitatory neurotransmitter in the CENTRAL NERVOUS SYSTEM.
Chemical Structure Depiction
Conformer generation is disallowed since MMFF94s unsupported element
bis[(5R)-5-amino-4,8-dioxo-1,3,2-dioxalumocan-2-yl] (2S)-2-aminopentanedioate
Computed by LexiChem 2.6.6 (PubChem release 2019.06.18)
InChI=1S/3C5H9NO4.2Al/c3*6-3(5(9)10)1-2-4(7)8;;/h3*3H,1-2,6H2,(H,7,8)(H,9,10);;/q;;;2*+3/p-6/t3*3-;;/m110../s1
Computed by InChI 1.0.5 (PubChem release 2019.06.18)
JGUXSUJNBHSZSR-RKDFOFCDSA-H
Computed by InChI 1.0.5 (PubChem release 2019.06.18)
C1CC(=O)O[Al](OC(=O)[C@@H]1N)OC(=O)CC[C@@H](C(=O)O[Al]2OC(=O)CC[C@H](C(=O)O2)N)N
Computed by OEChem 2.3.0 (PubChem release 2024.12.12)
C15H21Al2N3O12
Computed by PubChem 2.1 (PubChem release 2019.06.18)
- Aluminum L Glutamate
- Aluminum L-Glutamate
- D Glutamate
- D-Glutamate
- Glutamate
- Glutamate, Potassium
- Glutamic Acid
- Glutamic Acid, (D)-Isomer
- L Glutamate
- L Glutamic Acid
- L-Glutamate
- L-Glutamate, Aluminum
- L-Glutamic Acid
- Potassium Glutamate
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
489.30 g/mol
Reference
Computed by PubChem 2.1 (PubChem release 2021.05.07)
Property Name
Hydrogen Bond Donor Count
Property Value
3
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Hydrogen Bond Acceptor Count
Property Value
15
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Rotatable Bond Count
Property Value
8
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Exact Mass
Property Value
489.075600 Da
Reference
Computed by PubChem 2.1 (PubChem release 2021.05.07)
Property Name
Monoisotopic Mass
Property Value
489.075600 Da
Reference
Computed by PubChem 2.1 (PubChem release 2021.05.07)
Property Name
Topological Polar Surface Area
Property Value
236 Ų
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Heavy Atom Count
Property Value
32
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
781
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
3
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
1
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2016.09.28)
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Same Connectivity Count
Same Parent, Connectivity Count
Similar Compounds (2D)
Similar Conformers (3D)
Same Count
Patents are available for this chemical structure:
https://patentscope.wipo.int/search/en/result.jsf?inchikey=JGUXSUJNBHSZSR-RKDFOFCDSA-H
- Springer Nature
- Medical Subject Headings (MeSH)LICENSEWorks produced by the U.S. government are not subject to copyright protection in the United States. Any such works found on National Library of Medicine (NLM) Web sites may be freely used or reproduced without permission in the U.S.https://www.nlm.nih.gov/copyright.htmlGlutamic Acidhttps://www.ncbi.nlm.nih.gov/mesh/68018698
- PubChem
- PATENTSCOPE (WIPO)SID 390651803https://pubchem.ncbi.nlm.nih.gov/substance/390651803
CONTENTS