L-(+)-Citrulline

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Systematic / IUPAC Name: N5-Carbamoyl-L-ornithine

ID: Reference1240

Other Names: L-Ornithine, N5-(aminocarbonyl)-;
N5-(Aminocarbonyl)-L-ornithine;
(2S)-2-Amino-5-(carbamoylamino)pentanoic acid;
(S)-2-Amino-5-(aminocarbonyl)aminopentanoic acid;
(S)-2-Amino-5-ureidopentanoic acid ; more

Formula: C6H13N3O3

Class: Endogenous Metabolites

Spectral Data

L-(+)-Citrulline mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite; Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 502
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 12/4/2014 2:06:38 PM
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Identificators

InChI InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)
InChI Key RHGKLRLOHDJJDR-UHFFFAOYSA-N
Canonical SMILES C(CC(C(=O)O)N)CNC(=O)N
CAS 372758
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Other Names L-Ornithine, N5-(aminocarbonyl)-;
N5-(Aminocarbonyl)-L-ornithine;
(2S)-2-Amino-5-(carbamoylamino)pentanoic acid;
(S)-2-Amino-5-(aminocarbonyl)aminopentanoic acid;
(S)-2-Amino-5-ureidopentanoic acid;
2-Amino-5-ureidovaleric acid;
L-(+)-2-Amino-5-ureidovaleric acid;
L-2-Amino-5-ureidovaleric acid;
Ornithine, N-5-(aminocarbonyl)-;
Ureidovaleric acid;
α-Amino-Υ-ureidovaleric acid;
L-Citrulline;
Citrulline;
Citrulline, L-;
N5-Carbamoylornithine

In Other Databases

KEGG C00327; D07706
PubChem 9750
ChemIDPlus 000372758
ChEMBL CHEMBL444814
ChemSpider 810
Wikipedia Citrulline
ChEBI CHEBI:16349; CHEBI:57743
HMDb HMDB00904