Phosphocreatine

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Systematic / IUPAC Name: N-Methyl-N-(N-phosphonocarbamimidoyl)glycine

ID: Reference7181

Other Names: N-(ω)-Phosphonocreatine;
N-(N-Phosphonoamido)sarcosine;
N-(Phosphonoamidino)-sarcosine;
N-Phosphocreatine;
N-Phosphorocreatine ; more

Formula: C4H10N3O5P

Spectral Data

Phosphocreatine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/14/2017 10:21:33 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C4H10N3O5P/c1-7(2-3(8)9)4(5)6-13(10,11)12/h2H2,1H3,(H,8,9)(H4,5,6,10,11,12)
InChI Key DRBBFCLWYRJSJZ-UHFFFAOYSA-N
Canonical SMILES CN(CC(=O)O)C(=NP(=O)(O)O)N
CAS
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Other Names N-(ω)-Phosphonocreatine;
N-(N-Phosphonoamido)sarcosine;
N-(Phosphonoamidino)-sarcosine;
N-Phosphocreatine;
N-Phosphorocreatine;
N-Phosphorylcreatine;
Creatine phosphate;
Creatine phosphic acid;
Creatine-P;
Creatinephosphoric acid;
Phosphorylcreatine;
{[Imino(phosphonoamino)methyl](methyl)amino}acetic acid;
N-[Imino(phosphonoamino)methyl]-N-methyl-glycine;
2-(1-Methyl-3-phosphonocarbamimidamido)acetic acid;
Glycine, N-[imino(phosphonoamino)methyl]-N-methyl-

In Other Databases

ChemIDPlus 000067072
PubChem 587; 9548602
HMDb HMDB01511
ChEBI CHEBI:17287
ChEMBL CHEMBL1204644
KEGG C02305
ChemSpider 567
Wikipedia Phosphocreatine