RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0136634
RefMet name	Arabinose
Systematic name	(2S,3R,4R)-2,3,4,5-tetrahydroxypentanal
Synonyms	PubChem Synonyms
Exact mass	150.052825 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C5H10O5	View other entries in RefMet with this formula
Molecular descriptors
Molfile	44128 (Download molfile/View MW Metabolite Database details)
InChI	InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4-,5+/m1/s1
InChIKey	PYMYPHUHKUWMLA-WDCZJNDASA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	C(=O)[C@H]([C@@H]([C@@H](CO)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Carbohydrates
Main Class	Monosaccharides
Sub Class	Pentoses
Distribution of Arabinose 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 Arabinose
External Links
Pubchem CID	66308
ChEBI ID	46983
KEGG ID	C00216
HMDB ID	HMDB0029942
Chemspider ID	59687
MetaCyc ID	CPD-15700
EPA CompTox	DTXCID50209607
Spectral data for Arabinose standards
MassBank(EU)	View MS spectra
Structural annotation level
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)