RefMet Compound Details
RefMet ID, RefMet name, exact mass and formula | ||
RefMet ID | RM0014090 | |
---|---|---|
RefMet name | Arg-Thr | |
Systematic name | L-Arginyl-L-threonine | |
Synonyms | PubChem Synonyms | |
Exact mass | 275.159355 (neutral) | Calculate m/z:
View other RefMet entries with this exact (neutral) mass: +/- 0.05 amu +/- 0.1 amu +/- 0.2 amu +/- 0.5 amu |
Formula | C10H21N5O4 | View other entries in RefMet with this formula |
Molecular descriptors | ||
Molfile | 78692 (Download molfile/View MW Metabolite Database details) | |
InChI | InChI=1S/C10H21N5O4/c1-5(16)7(9(18)19)15-8(17)6(11)3-2-4-14-10(12)13/h5-7,16H,2-4,11H2,1H3,(H,15,17)(H,18,19)(H4,12,13,14)/t5-,6-, 7-/m0/s1 | |
InChIKey | XNSKSTRGQIPTSE-VQVTYTSYSA-N | View other enantiomers/diastereomers of this metabolite in RefMet |
SMILES | C[C@H]([C@@H](C(=O)O)NC(=O)[C@H](CCCNC(=N)N)N)O
Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Chemical/Biochemical Classification | ||
Super Class | Organic acids | |
Main Class | Amino acids and peptides | |
Sub Class | Dipeptides | |
Distribution of Arg-Thr in NMDR studies | ||
Species | Plot Species distribution | |
Sample source | Plot Sample source(tissue) distribution | |
Platform | Platform (MS/NMR) used for detection | |
Chromatography | Chromatography methods used for detection | |
Studies | NMDR Studies reporting Arg-Thr | |
External Links | ||
Pubchem CID | 145453488 | |
ChEBI ID | 195584 | |
HMDB ID | HMDB0028719 | |
Structural annotation level | ||
Annotation level | 1 (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition) |