Guanidinosuccinic acid

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Systematic / IUPAC Name: 2-(Diaminomethylideneamino)butanedioic acid

ID: Reference435

Other Names: N-(Aminoiminomethyl)-L-aspartic acid;
(2S)-2-Carbamimidamidobutanedioic acid;
N-Amidino-L-aspartate;
N-Carbamimidoyl-L-aspartic acid;
N-Amidino-L-aspartic acid ; more

Formula: C5H9N3O4

Class: Natural Toxins Endogenous Metabolites

Spectral Data

Guanidinosuccinic acid 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 3
No. of Spectra 386
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI
Analyzers FT
Last Modification 1/20/2015 9:04:58 AM
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Identificators

InChI InChI=1S/C5H9N3O4/c6-5(7)8-2(4(11)12)1-3(9)10/h2H,1H2,(H,9,10)(H,11,12)(H4,6,7,8)/t2-/m0/s1
InChI Key VVHOUVWJCQOYGG-REOHCLBHSA-N
Canonical SMILES O=C(O)CC(/N=C(/N)N)C(=O)O
CAS 6133308
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Other Names N-(Aminoiminomethyl)-L-aspartic acid;
(2S)-2-Carbamimidamidobutanedioic acid;
N-Amidino-L-aspartate;
N-Carbamimidoyl-L-aspartic acid;
N-Amidino-L-aspartic acid;
L-N-Amidinoaspartic acid;
Guanidinosuccinate

In Other Databases

PubChem 439918
KEGG C03139
HMDb HMDB03157
ChemSpider 388951
ChEBI CHEBI:17072