RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0135881
RefMet name	CTP
Systematic name	Cytidine-5'- triphosphate
Synonyms	PubChem Synonyms
Exact mass	482.984521 (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	C9H16N3O14P3	View other entries in RefMet with this formula
Molecular descriptors
Molfile	37065 (Download molfile/View MW Metabolite Database details)
InChI	InChI=1S/C9H16N3O14P3/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H, 19,20)(H,21,22)(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
InChIKey	PCDQPRRSZKQHHS-XVFCMESISA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	c1cn([C@H]2[C@@H]([C@@H]([C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)O)O)c(=O)nc1N Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Nucleic acids
Main Class	Pyrimidines
Sub Class	Pyrimidine rNTP
Distribution of CTP 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 CTP
External Links
Pubchem CID	6176
ChEBI ID	17677
KEGG ID	C00063
HMDB ID	HMDB0000082
Chemspider ID	5941
MetaCyc ID	CTP
Spectral data for CTP standards
BMRB ID(NMR)	View NMR spectra
NP-MRD ID(NMR)	View NMR spectra
MassBank(EU)	View MS spectra
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 CTP

Rxn ID	KEGG Reaction	Enzyme
R00515	CTP + H2O <=> CMP + Diphosphate	CTP diphosphohydrolase (diphosphate-forming)
R00568	CTP + H2O <=> UTP + Ammonia	CTP aminohydrolase
R00569	CTP + H2O <=> CDP + Orthophosphate	CTP phosphohydrolase
R00570	ATP + CDP <=> ADP + CTP	ATP:CDP phosphotransferase
R00571	ATP + UTP + Ammonia <=> ADP + Orthophosphate + CTP	UTP:ammonia ligase (ADP-forming)
R00573	ATP + UTP + L-Glutamine + H2O <=> ADP + Orthophosphate + CTP + L-Glutamate	UTP:L-glutamine amido-ligase (ADP-forming)

Table of KEGG human pathways containing CTP

Pathway ID	Human Pathway	# of reactions
hsa00240	Pyrimidine metabolism	5
hsa01100	Metabolic pathways	2
hsa01232	Nucleotide metabolism	2
hsa01240	Biosynthesis of cofactors	2
hsa00040	Pentose and glucuronate interconversions	1
hsa00515	Mannose type O-glycan biosynthesis	1