Metabolomics Structure Database

MDLMOL SDF CSV TSV

MW REGNO:	73592
Common Name:	2',3'-cyclic UMP
Systematic Name:	alpha-D-ribofuranosyl uridine-2',3'-cyclic phosphate
RefMet Name:	2',3' cyclic UMP
Synonyms:	uridine 2',3'-cyclic monophosphate [PubChem Synonyms]
Exact Mass:	306.0253 (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:	C9H11N2O8P
InChIKey:	HWDMHJDYMFRXOX-XVFCMESISA-N
ClassyFire superclass:	Nucleosides, nucleotides, and analogues [C0000289]
ClassyFire class:	Pyrimidine nucleotides [C0001509]
ClassyFire subclass:	Cyclic pyrimidine nucleotides [C0001492]
ClassyFire direct parent:	2',3'-cyclic pyrimidine nucleotides [C0001495]
SMILES:	c1cn([C@H]2[C@H]3[C@@H]([C@@H](CO)O2)OP(=O)(O)O3)c(=O)[nH]c1=O
Studies:	Available studies (via RefMet name)

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All Database Links Calculated Properties Human Pathways

External database links:

PubChem CID:	439715
HMDB ID:	HMDB0011640
Plant Metabolite Hub(Pmhub):	MS000017543

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