RefMet Compound Details
RefMet ID, RefMet name, exact mass and formula | ||
RefMet ID | RM0108987 | |
---|---|---|
RefMet name | Galactosylglycerol | |
Systematic name | (2R,3R,4S,5R,6R)-2-(2,3-dihydroxypropoxy)-6-(hydroxymethyl)oxane-3,4,5-triol | |
Synonyms | PubChem Synonyms | |
Exact mass | 254.100170 (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 | C9H18O8 | View other entries in RefMet with this formula |
Molecular descriptors | ||
Molfile | 39034 (Download molfile/View MW Metabolite Database details) | |
InChI | InChI=1S/C9H18O8/c10-1-4(12)3-16-9-8(15)7(14)6(13)5(2-11)17-9/h4-15H,1-3H2/t4?,5-,6+,7+,8-,9-/m1/s1 | |
InChIKey | NHJUPBDCSOGIKX-VGPGGAHRSA-N | View other enantiomers/diastereomers of this metabolite in RefMet |
SMILES | C(C(CO[C@H]1[C@@H]([C@H]([C@H]([C@@H](CO)O1)O)O)O)O)O
Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Chemical/Biochemical Classification | ||
Super Class | Carbohydrates | |
Main Class | Glycosyl compounds | |
Sub Class | Glycosylglycerols | |
Distribution of Galactosylglycerol 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 Galactosylglycerol | |
External Links | ||
Pubchem CID | 656504 | |
ChEBI ID | 150213 | |
KEGG ID | C05401 | |
HMDB ID | HMDB0006790 | |
Chemspider ID | 570889 | |
MetaCyc ID | 3-B-D-GALACTOSYL-SN-GLYCEROL | |
Structural annotation level | ||
Annotation level | 1 (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition) |
Table of KEGG reactions in human pathways involving Galactosylglycerol
Rxn ID | KEGG Reaction | Enzyme |
---|---|---|
R01104 | 3-beta-D-Galactosyl-sn-glycerol + H2O <=> D-Galactose + Glycerol | Galactosylglycerol galactohydrolase |
Table of KEGG human pathways containing Galactosylglycerol
Pathway ID | Human Pathway | # of reactions |
---|---|---|
hsa00052 | Galactose metabolism | 1 |