Metabolomics Structure Database

MDLMOL SDF CSV TSV

MW REGNO:	50882
Common Name:	D-ribulose 5-phosphate
Systematic Name:	5-O-phosphono-D-ribulose
RefMet Name:	Ribulose 5-phosphate
Synonyms:	D-erythro-pent-2-ulose 5-(dihydrogen phosphate) [PubChem Synonyms]
Exact Mass:	230.0192 (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-H+2K]+ [M+Na]+ [M+2Na]2+ [M-H+2Na]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M-H]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+HCOO]- M(neutral)
Formula:	C5H11O8P
InChIKey:	FNZLKVNUWIIPSJ-UHNVWZDZSA-N
ClassyFire superclass:	Organic oxygen compounds [C0004603]
ClassyFire class:	Organooxygen compounds [C0000323]
ClassyFire subclass:	Carbohydrates and carbohydrate conjugates [C0000011]
ClassyFire direct parent:	Pentose phosphates [C0002259]
MoNA MS spectra:	View MS spectra
SMILES:	C(C(=O)[C@@H]([C@@H](COP(=O)(O)O)O)O)O
Studies:	Available studies (via RefMet name)

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All Database Links Calculated Properties Human Pathways

External database links:

PubChem CID:	439184
CHEBI ID:	17363
HMDB ID:	HMDB0000618
KEGG ID:	C00199
MetaCyc ID:	RIBULOSE-5P
Plant Metabolite Hub(Pmhub):	MS000001081

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y