Carbobenzoxyglutamine
PubChem CID
75855
Structure
Chemical Safety
Molecular Formula
Synonyms
- 2650-64-8
- Z-Gln-OH
- N-Carbobenzyloxy-L-glutamine
- Carbobenzoxyglutamine
- Cbz-Gln-OH
Molecular Weight
280.28 g/mol
Computed by PubChem 2.2 (PubChem release 2024.11.20)
Dates
- Create:2005-07-11
- Modify:2025-01-18
Chemical Structure Depiction
SVG Image
IUPAC Condensed
Cbz-Gln-OH
Sequence
Q
HELM
PEPTIDE1{[c1ccc(cc1)COC(=O)N[C@@H](CCC(=O)N)C(=O)O]}$$$$
IUPAC
N-benzoxycarbonyl-L-glutamine
(2S)-5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid
Computed by Lexichem TK 2.7.0 (PubChem release 2024.11.20)
InChI=1S/C13H16N2O5/c14-11(16)7-6-10(12(17)18)15-13(19)20-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H2,14,16)(H,15,19)(H,17,18)/t10-/m0/s1
Computed by InChI 1.07.0 (PubChem release 2024.11.20)
JIMLDJNLXLMGLX-JTQLQIEISA-N
Computed by InChI 1.07.0 (PubChem release 2024.11.20)
C1=CC=C(C=C1)COC(=O)N[C@@H](CCC(=O)N)C(=O)O
Computed by OEChem 2.3.0 (PubChem release 2024.12.12)
C13H16N2O5
Computed by PubChem 2.2 (PubChem release 2024.11.20)
22259-08-1
- 2650-64-8
- Z-Gln-OH
- N-Carbobenzyloxy-L-glutamine
- Carbobenzoxyglutamine
- Cbz-Gln-OH
- N-Carbobenzoxy-L-glutamine
- N-Cbz-L-glutamine
- Benzyloxycarbonyl-L-glutamine
- L-Glutamine, N2-[(phenylmethoxy)carbonyl]-
- Carbobenzoxy-L-glutamine
- (Benzyloxycarbonyl)glutamine
- N2-Carbobenzoxy-L-glutamine
- N2-Benzyloxycarbonyl-L-glutamine
- Z-L-Glutamine
- N(2)-Benzoxycarbonyl-L-glutamine
- Glutamine, N-(benzyloxy)carbonyl-
- CBZ-L-Glutamine
- (2S)-5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid
- NSC 186903
- N-(Benzyloxycarbonyl)-L-glutamine
- (2S)-2-{[(benzyloxy)carbonyl]amino}-4-carbamoylbutanoic acid
- Glutamine, N2-carboxy-, N2-benzyl ester, L-
- MFCD00008043
- Carbobenzyloxy-L-glutamine
- L-Glutamine, N2-((phenylmethoxy)carbonyl)-
- N-Benzyloxycarbonyl-L-glutamine
- Z-L-GLN-OH
- L-Glutamine, N-[(phenylmethoxy)carbonyl]-
- N.alpha.-Benzyloxycarbonyl-L-glutamine
- EINECS 220-173-8
- Nalpha-Benzyloxycarbonyl-L-glutamine
- Z-Gln
- N(alpha)-Benzyloxycarbonyl-L-glutamine
- N-Benzyloxycarbonylglutamine
- Z-Gln-OH, 99%
- N-benzyloxycarbony-L-glutamine
- SCHEMBL716987
- DTXSID50883880
- ((Benzyloxy)carbonyl)-L-glutamine
- Nalpha -benzyloxycarbonyl-L-glutamine
- AKOS010385670
- AKOS015924213
- CS-W010055
- HY-W009339
- AC-17139
- AS-12742
- N2-((Phenylmethoxy)carbonyl)-L-glutamine
- N-ALPHA-BENZYLOXYCARBONYL-L-GLUTAMINE
- NS00048060
- D71209
- EN300-121311
- M03034
- J-300129
- (S)-5-AMINO-2-(BENZYLOXYCARBONYLAMINO)-5-OXOPENTANOIC ACID
- [3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanol; 3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenemethanol;
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
280.28 g/mol
Reference
Computed by PubChem 2.2 (PubChem release 2024.11.20)
Property Name
XLogP3-AA
Property Value
0.3
Reference
Computed by XLogP3 3.0 (PubChem release 2024.11.20)
Property Name
Hydrogen Bond Donor Count
Property Value
3
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2024.11.20)
Property Name
Hydrogen Bond Acceptor Count
Property Value
5
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2024.11.20)
Property Name
Rotatable Bond Count
Property Value
8
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2024.11.20)
Property Name
Exact Mass
Property Value
280.10592162 Da
Reference
Computed by PubChem 2.2 (PubChem release 2024.11.20)
Property Name
Monoisotopic Mass
Property Value
280.10592162 Da
Reference
Computed by PubChem 2.2 (PubChem release 2024.11.20)
Property Name
Topological Polar Surface Area
Property Value
119 Ų
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2024.11.20)
Property Name
Heavy Atom Count
Property Value
20
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
353
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2024.11.20)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
1
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 2021.10.14)
NIST Number
76517
Library
Main library
Total Peaks
104
m/z Top Peak
91
m/z 2nd Highest
108
m/z 3rd Highest
79
Thumbnail
NIST Number
234273
Library
Replicate library
Total Peaks
124
m/z Top Peak
108
m/z 2nd Highest
79
m/z 3rd Highest
91
Thumbnail
Follow these links to do a live 2D search or do a live 3D search for this compound, sorted by annotation score. This section is deprecated (see here for details), but these live search links provide equivalent functionality to the table that was previously shown here.
Same Connectivity Count
Same Stereo Count
Same Isotope Count
Same Parent, Connectivity Count
Same Parent, Stereo Count
Same Parent, Isotope Count
Same Parent, Exact Count
Mixtures, Components, and Neutralized Forms Count
Similar Compounds (2D)
Similar Conformers (3D)
PubMed Count
EPA TSCA Commercial Activity Status
L-Glutamine, N2-[(phenylmethoxy)carbonyl]-: INACTIVE
GHS Hazard Statements
Not Classified
Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.
Not Classified
New Zealand EPA Inventory of Chemical Status
L-Glutamine, N2-(phenylmethoxy)carbonyl-: Does not have an individual approval but may be used under an appropriate group standard
Patents are available for this chemical structure:
https://patentscope.wipo.int/search/en/result.jsf?inchikey=JIMLDJNLXLMGLX-JTQLQIEISA-N
- CAS Common ChemistryLICENSEThe data from CAS Common Chemistry is provided under a CC-BY-NC 4.0 license, unless otherwise stated.https://creativecommons.org/licenses/by-nc/4.0/N2-[(Phenylmethoxy)carbonyl]-L-glutaminehttps://commonchemistry.cas.org/detail?cas_rn=2650-64-8
- ChemIDplusL-Glutamine, N2-((phenylmethoxy)carbonyl)-https://pubchem.ncbi.nlm.nih.gov/substance/?source=chemidplus&sourceid=0002650648ChemIDplus Chemical Information Classificationhttps://pubchem.ncbi.nlm.nih.gov/source/ChemIDplus
- EPA Chemicals under the TSCAL-Glutamine, N2-[(phenylmethoxy)carbonyl]-https://www.epa.gov/chemicals-under-tscaEPA TSCA Classificationhttps://www.epa.gov/tsca-inventory
- EPA DSSToxL-Glutamine, N2-[(phenylmethoxy)carbonyl]-https://comptox.epa.gov/dashboard/DTXSID50883880CompTox Chemicals Dashboard Chemical Listshttps://comptox.epa.gov/dashboard/chemical-lists/
- European Chemicals Agency (ECHA)LICENSEUse of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: "Source: European Chemicals Agency, http://echa.europa.eu/". Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page.https://echa.europa.eu/web/guest/legal-noticeN2-[(phenylmethoxy)carbonyl]-L-glutaminehttps://echa.europa.eu/substance-information/-/substanceinfo/100.018.340N2-[(phenylmethoxy)carbonyl]-L-glutamine (EC: 220-173-8)https://echa.europa.eu/information-on-chemicals/cl-inventory-database/-/discli/details/27465
- New Zealand Environmental Protection Authority (EPA)LICENSEThis work is licensed under the Creative Commons Attribution-ShareAlike 4.0 International licence.https://www.epa.govt.nz/about-this-site/general-copyright-statement/L-Glutamine, N2-(phenylmethoxy)carbonyl-https://www.epa.govt.nz/industry-areas/hazardous-substances/guidance-for-importers-and-manufacturers/hazardous-substances-databases/
- Japan Chemical Substance Dictionary (Nikkaji)
- NIST Mass Spectrometry Data CenterLICENSEData covered by the Standard Reference Data Act of 1968 as amended.https://www.nist.gov/srd/public-lawL-Glutamine, N2-[(phenylmethoxy)carbonyl]-http://www.nist.gov/srd/nist1a.cfm
- SpectraBaseN-(BENZYLOXYCARBONYL)-GLUTAMINEhttps://spectrabase.com/spectrum/7tsMPzYGQZ9Z-L-Glutaminehttps://spectrabase.com/spectrum/EDg1dH3bhszZ-L-Glutaminehttps://spectrabase.com/spectrum/2uGTMyNdc2EZ-L-Glutaminehttps://spectrabase.com/spectrum/KnGBsMMMx8t
- Springer Nature
- Thieme ChemistryLICENSEThe Thieme Chemistry contribution within PubChem is provided under a CC-BY-NC-ND 4.0 license, unless otherwise stated.https://creativecommons.org/licenses/by-nc-nd/4.0/
- WikidataN-Carbobenzyloxy-L-glutaminehttps://www.wikidata.org/wiki/Q72515291
- PubChem
- GHS Classification (UNECE)GHS Classification Treehttp://www.unece.org/trans/danger/publi/ghs/ghs_welcome_e.html
- NORMAN Suspect List ExchangeLICENSEData: CC-BY 4.0; Code (hosted by ECI, LCSB): Artistic-2.0https://creativecommons.org/licenses/by/4.0/NORMAN Suspect List Exchange Classificationhttps://www.norman-network.com/nds/SLE/
- EPA Substance Registry ServicesEPA SRS List Classificationhttps://sor.epa.gov/sor_internet/registry/substreg/LandingPage.do
- MolGenieMolGenie Organic Chemistry Ontologyhttps://github.com/MolGenie/ontology/
- PATENTSCOPE (WIPO)SID 388337962https://pubchem.ncbi.nlm.nih.gov/substance/388337962
CONTENTS