Hmdb loader
Record Information
Version5.0
StatusDetected and Quantified
Creation Date2005-11-16 15:48:42 UTC
Update Date2022-09-22 18:34:15 UTC
HMDB IDHMDB0001511
Secondary Accession Numbers
  • HMDB01511
Metabolite Identification
Common NamePhosphocreatine
DescriptionPhosphocreatine, also known as creatine phosphate (CP) or PCr (Pcr), is a phosphorylated creatine molecule that serves as a rapidly mobilizable reserve of high-energy phosphates in skeletal muscle, myocardium and the brain to recycle adenosine triphosphate, the energy currency of the cell. Phosphocreatine undergoes irreversible cyclization and dehydration to form creatinine at a fractional rate of 0.026 per day, thus forming approximately 2 g creatinine/day in an adult male. This is the amount of creatine that must be provided either from dietary sources or by endogenous synthesis to maintain the body pool of (creatine and) phosphocreatine. Creatine is an amino acid that plays a vital role as phosphocreatine in regenerating adenosine triphosphate in skeletal muscle to energize muscle contraction. Creatine is phosphorylated to phosphocreatine in muscle in a reaction that is catalyzed by the enzyme creatine kinase. This enzyme is in highest concentration in muscle and nerve. Oral administration increases muscle stores. During the past decade, creatine has assumed prominence as an ergogenic (and legal) aid for professional and elite athletes. Most (~ 95%) of the total body creatine-phosphocreatine pool is in muscle (more in skeletal muscle than in smooth muscle) and amounts to 120 g (or 925 mmol) in a 70 kg adult male. Approximately 60-67% of the content in resting muscle is in the phosphorylated form. This generates enough ATP at the myofibrillar apparatus to power about 4 seconds of muscle contraction in exercise. Phosphocreatine reacts with ADP to yield ATP and creatine; the reversible reaction is catalyzed by creatine kinase. phosphocreatine is the chief store of high-energy phosphates in muscle. Thus, this reaction, which permits the rephosphorylation of ADP to ATP, is the immediate source of energy in muscle contraction. During rest, metabolic processes regenerate phosphocreatine stores. In normal muscle, ATP that is broken down to ADP is immediately rephosphorylated to ATP. Thus, phosphocreatine serves as a reservoir of ATP-synthesizing potential. phosphocreatine is the only fuel available to precipitously regenerate ATP during episodes of rapid fluctuations in demand. The availability of phosphocreatine likely limits muscle performance during brief, high-power exercise, i.e., maximal exercise of short duration. With near maximal isometric contraction, the rate of utilization of phosphocreatine declines after 1-2 seconds of contraction, prior to the glycolysis peak at approximately 3 seconds (PMID:10079702 ).
Structure
Data?1585156553
Synonyms
ValueSource
Creatine phosphateChEBI
Creatine phosphic acidChEBI
N-(N-Phosphonoamido)sarcosineChEBI
N-(Phosphonoamidino)sarcosineChEBI
N-PhosphorylcreatineChEBI
N(Omega)-phosphonocreatineChEBI
PhosphorylcreatineChEBI
{[imino(phosphonoamino)methyl](methyl)amino}acetic acidChEBI
N-PhosphocreatineKegg
Creatine phosphoric acidGenerator
{[imino(phosphonoamino)methyl](methyl)amino}acetateGenerator
Creatine-pHMDB
Creatine-phosphateHMDB
Creatinephosphoric acidHMDB
N-(Phosphonoamidino)-sarcosineHMDB
N-PhosphorocreatineHMDB
N-[Imino(phosphonoamino)methyl]-N-methyl-glycineHMDB
Neo-tonHMDB
p-CreatineHMDB
Chemical FormulaC4H10N3O5P
Average Molecular Weight211.1131
Monoisotopic Molecular Weight211.035806957
IUPAC Name2-(N-methyl-N'-phosphonocarbamimidamido)acetic acid
Traditional Namecreatine-phosphate
CAS Registry Number67-07-2
SMILES
CN(CC(O)=O)C(=N)NP(O)(O)=O
InChI Identifier
InChI=1S/C4H10N3O5P/c1-7(2-3(8)9)4(5)6-13(10,11)12/h2H2,1H3,(H,8,9)(H4,5,6,10,11,12)
InChI KeyDRBBFCLWYRJSJZ-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassAmino acids, peptides, and analogues
Direct ParentAlpha amino acids and derivatives
Alternative Parents
Substituents
  • Alpha-amino acid or derivatives
  • Organic phosphoric acid derivative
  • Guanidine
  • Monocarboxylic acid or derivatives
  • Carboxylic acid
  • Organic nitrogen compound
  • Organic oxygen compound
  • Organopnictogen compound
  • Organic oxide
  • Hydrocarbon derivative
  • Organooxygen compound
  • Organonitrogen compound
  • Carbonyl group
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
Biological locationSource
Process
Role
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic Properties

Experimental Collision Cross Sections

Adduct TypeData SourceCCS Value (Å2)Reference
[M-H]-Astarita_neg140.730932474
[M+H]+Baker153.76730932474
[M+H]+MetCCS_train_pos144.4430932474
[M+H]+Not Available144.7http://allccs.zhulab.cn/database/detail?ID=AllCCS00000498
Predicted Molecular Properties
PropertyValueSource
Water Solubility3.52 g/LALOGPS
logP-2ALOGPS
logP-2.3ChemAxon
logS-1.8ALOGPS
pKa (Strongest Acidic)-1.1ChemAxon
pKa (Strongest Basic)13.53ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count7ChemAxon
Hydrogen Donor Count5ChemAxon
Polar Surface Area133.95 ŲChemAxon
Rotatable Bond Count3ChemAxon
Refractivity53.18 m³·mol⁻¹ChemAxon
Polarizability16.82 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+146.15731661259
DarkChem[M+H]+146.15731661259
DarkChem[M-H]-141.27331661259
DarkChem[M-H]-141.27331661259
AllCCS[M+H]+145.5832859911
AllCCS[M-H]-138.35632859911
DeepCCS[M+H]+134.73330932474
DeepCCS[M-H]-130.90530932474
DeepCCS[M-2H]-168.49230932474
DeepCCS[M+Na]+144.03130932474
AllCCS[M+H]+145.632859911
AllCCS[M+H-H2O]+142.032859911
AllCCS[M+NH4]+148.932859911
AllCCS[M+Na]+149.832859911
AllCCS[M-H]-138.432859911
AllCCS[M+Na-2H]-139.832859911
AllCCS[M+HCOO]-141.432859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
PhosphocreatineCN(CC(O)=O)C(=N)NP(O)(O)=O3325.2Standard polar33892256
PhosphocreatineCN(CC(O)=O)C(=N)NP(O)(O)=O1693.6Standard non polar33892256
PhosphocreatineCN(CC(O)=O)C(=N)NP(O)(O)=O2222.0Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Phosphocreatine,1TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N)NP(=O)(O)O2060.2Semi standard non polar33892256
Phosphocreatine,1TMS,isomer #2CN(CC(=O)O)C(=N)NP(=O)(O)O[Si](C)(C)C2070.4Semi standard non polar33892256
Phosphocreatine,1TMS,isomer #3CN(CC(=O)O)C(=N[Si](C)(C)C)NP(=O)(O)O2080.4Semi standard non polar33892256
Phosphocreatine,1TMS,isomer #4CN(CC(=O)O)C(=N)N([Si](C)(C)C)P(=O)(O)O2079.8Semi standard non polar33892256
Phosphocreatine,2TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N)NP(=O)(O)O[Si](C)(C)C2050.9Semi standard non polar33892256
Phosphocreatine,2TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N)NP(=O)(O)O[Si](C)(C)C1891.7Standard non polar33892256
Phosphocreatine,2TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N)NP(=O)(O)O[Si](C)(C)C3499.6Standard polar33892256
Phosphocreatine,2TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O)O2039.1Semi standard non polar33892256
Phosphocreatine,2TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O)O1896.0Standard non polar33892256
Phosphocreatine,2TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O)O3683.1Standard polar33892256
Phosphocreatine,2TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O)O2041.2Semi standard non polar33892256
Phosphocreatine,2TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O)O1929.3Standard non polar33892256
Phosphocreatine,2TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O)O3501.0Standard polar33892256
Phosphocreatine,2TMS,isomer #4CN(CC(=O)O)C(=N)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C2048.1Semi standard non polar33892256
Phosphocreatine,2TMS,isomer #4CN(CC(=O)O)C(=N)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C1879.3Standard non polar33892256
Phosphocreatine,2TMS,isomer #4CN(CC(=O)O)C(=N)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C3229.3Standard polar33892256
Phosphocreatine,2TMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C)NP(=O)(O)O[Si](C)(C)C2040.6Semi standard non polar33892256
Phosphocreatine,2TMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C)NP(=O)(O)O[Si](C)(C)C1910.4Standard non polar33892256
Phosphocreatine,2TMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C)NP(=O)(O)O[Si](C)(C)C3284.0Standard polar33892256
Phosphocreatine,2TMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C2053.3Semi standard non polar33892256
Phosphocreatine,2TMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C1917.0Standard non polar33892256
Phosphocreatine,2TMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C3243.8Standard polar33892256
Phosphocreatine,2TMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O2062.6Semi standard non polar33892256
Phosphocreatine,2TMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O1997.2Standard non polar33892256
Phosphocreatine,2TMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O3256.5Standard polar33892256
Phosphocreatine,3TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C2054.4Semi standard non polar33892256
Phosphocreatine,3TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C1912.8Standard non polar33892256
Phosphocreatine,3TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C3072.4Standard polar33892256
Phosphocreatine,3TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O)O[Si](C)(C)C2017.6Semi standard non polar33892256
Phosphocreatine,3TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O)O[Si](C)(C)C1863.9Standard non polar33892256
Phosphocreatine,3TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O)O[Si](C)(C)C3124.5Standard polar33892256
Phosphocreatine,3TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C2029.9Semi standard non polar33892256
Phosphocreatine,3TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C1990.8Standard non polar33892256
Phosphocreatine,3TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C3074.2Standard polar33892256
Phosphocreatine,3TMS,isomer #4CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O2036.5Semi standard non polar33892256
Phosphocreatine,3TMS,isomer #4CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O1953.3Standard non polar33892256
Phosphocreatine,3TMS,isomer #4CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O3031.9Standard polar33892256
Phosphocreatine,3TMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C2051.2Semi standard non polar33892256
Phosphocreatine,3TMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C1910.4Standard non polar33892256
Phosphocreatine,3TMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C2869.8Standard polar33892256
Phosphocreatine,3TMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2062.3Semi standard non polar33892256
Phosphocreatine,3TMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2012.2Standard non polar33892256
Phosphocreatine,3TMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2867.9Standard polar33892256
Phosphocreatine,3TMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C2038.8Semi standard non polar33892256
Phosphocreatine,3TMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C1995.8Standard non polar33892256
Phosphocreatine,3TMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C2830.2Standard polar33892256
Phosphocreatine,4TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C2052.4Semi standard non polar33892256
Phosphocreatine,4TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C1885.9Standard non polar33892256
Phosphocreatine,4TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)NP(=O)(O[Si](C)(C)C)O[Si](C)(C)C2754.4Standard polar33892256
Phosphocreatine,4TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2091.3Semi standard non polar33892256
Phosphocreatine,4TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2064.8Standard non polar33892256
Phosphocreatine,4TMS,isomer #2CN(CC(=O)O[Si](C)(C)C)C(=N)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2783.6Standard polar33892256
Phosphocreatine,4TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C2044.6Semi standard non polar33892256
Phosphocreatine,4TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C1958.6Standard non polar33892256
Phosphocreatine,4TMS,isomer #3CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O)O[Si](C)(C)C2685.0Standard polar33892256
Phosphocreatine,4TMS,isomer #4CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2068.7Semi standard non polar33892256
Phosphocreatine,4TMS,isomer #4CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2026.3Standard non polar33892256
Phosphocreatine,4TMS,isomer #4CN(CC(=O)O)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2535.7Standard polar33892256
Phosphocreatine,5TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2105.1Semi standard non polar33892256
Phosphocreatine,5TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2007.4Standard non polar33892256
Phosphocreatine,5TMS,isomer #1CN(CC(=O)O[Si](C)(C)C)C(=N[Si](C)(C)C)N([Si](C)(C)C)P(=O)(O[Si](C)(C)C)O[Si](C)(C)C2439.7Standard polar33892256
Phosphocreatine,1TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)NP(=O)(O)O2327.3Semi standard non polar33892256
Phosphocreatine,1TBDMS,isomer #2CN(CC(=O)O)C(=N)NP(=O)(O)O[Si](C)(C)C(C)(C)C2320.9Semi standard non polar33892256
Phosphocreatine,1TBDMS,isomer #3CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O2317.8Semi standard non polar33892256
Phosphocreatine,1TBDMS,isomer #4CN(CC(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O2340.3Semi standard non polar33892256
Phosphocreatine,2TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)NP(=O)(O)O[Si](C)(C)C(C)(C)C2504.5Semi standard non polar33892256
Phosphocreatine,2TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)NP(=O)(O)O[Si](C)(C)C(C)(C)C2286.0Standard non polar33892256
Phosphocreatine,2TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)NP(=O)(O)O[Si](C)(C)C(C)(C)C3728.3Standard polar33892256
Phosphocreatine,2TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O2475.6Semi standard non polar33892256
Phosphocreatine,2TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O2245.9Standard non polar33892256
Phosphocreatine,2TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O3700.2Standard polar33892256
Phosphocreatine,2TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O2495.7Semi standard non polar33892256
Phosphocreatine,2TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O2306.0Standard non polar33892256
Phosphocreatine,2TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O3675.1Standard polar33892256
Phosphocreatine,2TBDMS,isomer #4CN(CC(=O)O)C(=N)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2513.8Semi standard non polar33892256
Phosphocreatine,2TBDMS,isomer #4CN(CC(=O)O)C(=N)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2282.1Standard non polar33892256
Phosphocreatine,2TBDMS,isomer #4CN(CC(=O)O)C(=N)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C3466.5Standard polar33892256
Phosphocreatine,2TBDMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O[Si](C)(C)C(C)(C)C2467.6Semi standard non polar33892256
Phosphocreatine,2TBDMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O[Si](C)(C)C(C)(C)C2239.2Standard non polar33892256
Phosphocreatine,2TBDMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O[Si](C)(C)C(C)(C)C3415.1Standard polar33892256
Phosphocreatine,2TBDMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2497.7Semi standard non polar33892256
Phosphocreatine,2TBDMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2290.9Standard non polar33892256
Phosphocreatine,2TBDMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C3441.7Standard polar33892256
Phosphocreatine,2TBDMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O2472.1Semi standard non polar33892256
Phosphocreatine,2TBDMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O2278.4Standard non polar33892256
Phosphocreatine,2TBDMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O3342.6Standard polar33892256
Phosphocreatine,3TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2692.4Semi standard non polar33892256
Phosphocreatine,3TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2449.6Standard non polar33892256
Phosphocreatine,3TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C3420.9Standard polar33892256
Phosphocreatine,3TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O[Si](C)(C)C(C)(C)C2636.4Semi standard non polar33892256
Phosphocreatine,3TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O[Si](C)(C)C(C)(C)C2377.6Standard non polar33892256
Phosphocreatine,3TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O)O[Si](C)(C)C(C)(C)C3322.9Standard polar33892256
Phosphocreatine,3TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2682.8Semi standard non polar33892256
Phosphocreatine,3TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2508.0Standard non polar33892256
Phosphocreatine,3TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C3386.9Standard polar33892256
Phosphocreatine,3TBDMS,isomer #4CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O2626.9Semi standard non polar33892256
Phosphocreatine,3TBDMS,isomer #4CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O2465.8Standard non polar33892256
Phosphocreatine,3TBDMS,isomer #4CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O3227.8Standard polar33892256
Phosphocreatine,3TBDMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2645.9Semi standard non polar33892256
Phosphocreatine,3TBDMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2371.6Standard non polar33892256
Phosphocreatine,3TBDMS,isomer #5CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C3125.4Standard polar33892256
Phosphocreatine,3TBDMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2702.3Semi standard non polar33892256
Phosphocreatine,3TBDMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2512.4Standard non polar33892256
Phosphocreatine,3TBDMS,isomer #6CN(CC(=O)O)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C3210.5Standard polar33892256
Phosphocreatine,3TBDMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2632.3Semi standard non polar33892256
Phosphocreatine,3TBDMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2421.9Standard non polar33892256
Phosphocreatine,3TBDMS,isomer #7CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C3085.4Standard polar33892256
Phosphocreatine,4TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2821.8Semi standard non polar33892256
Phosphocreatine,4TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2507.5Standard non polar33892256
Phosphocreatine,4TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)NP(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C3049.3Standard polar33892256
Phosphocreatine,4TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2876.2Semi standard non polar33892256
Phosphocreatine,4TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2681.6Standard non polar33892256
Phosphocreatine,4TBDMS,isomer #2CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C3186.1Standard polar33892256
Phosphocreatine,4TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2813.0Semi standard non polar33892256
Phosphocreatine,4TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2601.0Standard non polar33892256
Phosphocreatine,4TBDMS,isomer #3CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O)O[Si](C)(C)C(C)(C)C2985.2Standard polar33892256
Phosphocreatine,4TBDMS,isomer #4CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2829.1Semi standard non polar33892256
Phosphocreatine,4TBDMS,isomer #4CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2571.1Standard non polar33892256
Phosphocreatine,4TBDMS,isomer #4CN(CC(=O)O)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2893.7Standard polar33892256
Phosphocreatine,5TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2976.2Semi standard non polar33892256
Phosphocreatine,5TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2756.8Standard non polar33892256
Phosphocreatine,5TBDMS,isomer #1CN(CC(=O)O[Si](C)(C)C(C)(C)C)C(=N[Si](C)(C)C(C)(C)C)N([Si](C)(C)C(C)(C)C)P(=O)(O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C2885.0Standard polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Phosphocreatine GC-MS (Non-derivatized) - 70eV, Positivesplash10-00xu-8900000000-629042926c139865eee82017-08-28Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Phosphocreatine GC-MS (1 TMS) - 70eV, Positivesplash10-00y0-9450000000-df5020cc675b212f021d2017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Phosphocreatine GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine Quattro_QQQ 10V, Positive-QTOF (Annotated)splash10-03di-3690000000-d78c9794110f04d1d6332012-07-24HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine Quattro_QQQ 25V, Positive-QTOF (Annotated)splash10-004i-9000000000-da3c0dcb3f5eaa623db12012-07-24HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine Quattro_QQQ 40V, Positive-QTOF (Annotated)splash10-004i-9000000000-0b9440fbeacd93f8e2c62012-07-24HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ (API3000, Applied Biosystems) 10V, Positive-QTOFsplash10-0002-0910000000-fcb05b7d59cf907f4d6b2012-08-31HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ (API3000, Applied Biosystems) 20V, Positive-QTOFsplash10-0002-1900000000-1901e001fedfc2ec7b4b2012-08-31HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ (API3000, Applied Biosystems) 30V, Positive-QTOFsplash10-000b-2900000000-12f13784032f6e791b0b2012-08-31HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ (API3000, Applied Biosystems) 40V, Positive-QTOFsplash10-02a9-6900000000-946c0f3e6d7108360bdf2012-08-31HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ (API3000, Applied Biosystems) 50V, Positive-QTOFsplash10-00lr-9300000000-722ca5d041fac0c0f9532012-08-31HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-IT (LC/MSD Trap XCT, Agilent Technologies) , Positive-QTOFsplash10-03dl-0900000000-6b9000773d9aa9ba14962012-08-31HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-IT (LC/MSD Trap XCT, Agilent Technologies) , Positive-QTOFsplash10-03di-0900000000-02aa21f28669c46678762012-08-31HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-IT (LC/MSD Trap XCT, Agilent Technologies) , Positive-QTOFsplash10-000i-9200000000-1372c766f644a9c6d8fd2012-08-31HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ , positive-QTOFsplash10-0002-0910000000-fcb05b7d59cf907f4d6b2017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ , positive-QTOFsplash10-0002-1900000000-1e02029e1cea569106e32017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ , positive-QTOFsplash10-000b-2900000000-b5cede82b0440338b1ea2017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ , positive-QTOFsplash10-02a9-6900000000-946c0f3e6d7108360bdf2017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-QQ , positive-QTOFsplash10-00lr-9300000000-d6c9bf7b75ad1b890b8e2017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine LC-ESI-IT , positive-QTOFsplash10-03dl-0900000000-90e746baee09812140422017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine , positive-QTOFsplash10-03dl-6930000000-d778a54d1b16d7bf961a2017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phosphocreatine , positive-QTOFsplash10-03dl-6940000000-fce4c19798ec230e07042017-09-14HMDB team, MONAView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phosphocreatine 10V, Positive-QTOFsplash10-03di-3590000000-34c39ac175e1138311df2017-07-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phosphocreatine 20V, Positive-QTOFsplash10-00lu-5900000000-026fce60f9dbc70cfa3f2017-07-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phosphocreatine 40V, Positive-QTOFsplash10-00di-9200000000-4b05eb4ed02e14eb60292017-07-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phosphocreatine 10V, Negative-QTOFsplash10-03di-3980000000-c662d51968748ca689d82017-07-26Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phosphocreatine 20V, Negative-QTOFsplash10-0409-9630000000-6983e9fb7f6307837b6b2017-07-26Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phosphocreatine 40V, Negative-QTOFsplash10-00ba-9300000000-e548628e02490258e3752017-07-26Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Experimental 1D NMR1H NMR Spectrum (1D, 500 MHz, H2O, experimental)2012-12-04Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Experimental 2D NMR[1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, H2O, experimental)2012-12-05Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Mitochondria
Biospecimen Locations
  • Blood
  • Breast Milk
  • Urine
Tissue Locations
  • Adipose Tissue
  • Basal Ganglia
  • Brain
  • Epidermis
  • Fibroblasts
  • Kidney
  • Neuron
  • Placenta
  • Skeletal Muscle
  • Testis
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
Breast MilkDetected and Quantified22.9 +/- 17.1 uMAdult (>18 years old)Female
Normal
details
UrineDetected but not QuantifiedNot QuantifiedAdult (>18 years old)BothNormal details
UrineDetected and Quantified53.679 +/- 28.387 umol/mmol creatinineChildren (1 - 13 years old)Not Specified
Normal
    • Analysis of 30 no...
details
Abnormal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodExpected but not QuantifiedNot QuantifiedNot SpecifiedNot SpecifiedCancer patients undergoing total body irradiation details
UrineDetected and Quantified68.734 +/- 79.735 umol/mmol creatinineChildren (1 - 13 years old)Not Specified
Eosinophilic esophagitis
    • Analysis of 30 no...
details
Associated Disorders and Diseases
Disease References
Eosinophilic esophagitis
  1. Slae, M., Huynh, H., Wishart, D.S. (2014). Analysis of 30 normal pediatric urine samples via NMR spectroscopy (unpublished work). NA.
Associated OMIM IDs
DrugBank IDDB13191
Phenol Explorer Compound IDNot Available
FooDB IDFDB022665
KNApSAcK IDNot Available
Chemspider ID567
KEGG Compound IDC02305
BioCyc IDCREATINE-P
BiGG ID1594794
Wikipedia LinkPhosphocreatine
METLIN ID6288
PubChem Compound587
PDB IDNot Available
ChEBI ID17287
Food Biomarker OntologyNot Available
VMH IDPCREAT
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceHou, Lixiang. Method for producing creatine phosphate. Faming Zhuanli Shenqing Gongkai Shuomingshu (2004), 7 pp.
Material Safety Data Sheet (MSDS)Download (PDF)
General References
  1. Pastoris O, Dossena M, Foppa P, Catapano M, Arbustini E, Bellini O, Dal Bello B, Minzioni G, Ceriana P, Barzaghi N: Effect of L-carnitine on myocardial metabolism: results of a balanced, placebo-controlled, double-blind study in patients undergoing open heart surgery. Pharmacol Res. 1998 Feb;37(2):115-22. [PubMed:9572066 ]
  2. Schmidt A, Marescau B, Boehm EA, Renema WK, Peco R, Das A, Steinfeld R, Chan S, Wallis J, Davidoff M, Ullrich K, Waldschutz R, Heerschap A, De Deyn PP, Neubauer S, Isbrandt D: Severely altered guanidino compound levels, disturbed body weight homeostasis and impaired fertility in a mouse model of guanidinoacetate N-methyltransferase (GAMT) deficiency. Hum Mol Genet. 2004 May 1;13(9):905-21. Epub 2004 Mar 17. [PubMed:15028668 ]
  3. Gideon P, Henriksen O, Sperling B, Christiansen P, Olsen TS, Jorgensen HS, Arlien-Soborg P: Early time course of N-acetylaspartate, creatine and phosphocreatine, and compounds containing choline in the brain after acute stroke. A proton magnetic resonance spectroscopy study. Stroke. 1992 Nov;23(11):1566-72. [PubMed:1440704 ]
  4. Green AL, Hultman E, Macdonald IA, Sewell DA, Greenhaff PL: Carbohydrate ingestion augments skeletal muscle creatine accumulation during creatine supplementation in humans. Am J Physiol. 1996 Nov;271(5 Pt 1):E821-6. [PubMed:8944667 ]
  5. Skare OC, Skadberg, Wisnes AR: Creatine supplementation improves sprint performance in male sprinters. Scand J Med Sci Sports. 2001 Apr;11(2):96-102. [PubMed:11252467 ]
  6. Greenhaff PL, Soderlund K, Ren JM, Hultman E: Energy metabolism in single human muscle fibres during intermittent contraction with occluded circulation. J Physiol. 1993 Jan;460:443-53. [PubMed:8487203 ]
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Enzymes

General function:
Involved in kinase activity
Specific function:
Reversibly catalyzes the transfer of phosphate between ATP and various phosphogens (e.g. creatine phosphate). Creatine kinase isoenzymes play a central role in energy transduction in tissues with large, fluctuating energy demands, such as skeletal muscle, heart, brain and spermatozoa.
Gene Name:
CKMT2
Uniprot ID:
P17540
Molecular weight:
47504.08
Reactions
Adenosine triphosphate + Creatine → ADP + Phosphocreatinedetails
General function:
Involved in kinase activity
Specific function:
Reversibly catalyzes the transfer of phosphate between ATP and various phosphogens (e.g. creatine phosphate). Creatine kinase isoenzymes play a central role in energy transduction in tissues with large, fluctuating energy demands, such as skeletal muscle, heart, brain and spermatozoa.
Gene Name:
CKB
Uniprot ID:
P12277
Molecular weight:
42643.95
Reactions
Adenosine triphosphate + Creatine → ADP + Phosphocreatinedetails
General function:
Involved in kinase activity
Specific function:
Reversibly catalyzes the transfer of phosphate between ATP and various phosphogens (e.g. creatine phosphate). Creatine kinase isoenzymes play a central role in energy transduction in tissues with large, fluctuating energy demands, such as skeletal muscle, heart, brain and spermatozoa.
Gene Name:
CKMT1A
Uniprot ID:
P12532
Molecular weight:
47036.3
Reactions
Adenosine triphosphate + Creatine → ADP + Phosphocreatinedetails
General function:
Involved in kinase activity
Specific function:
Reversibly catalyzes the transfer of phosphate between ATP and various phosphogens (e.g. creatine phosphate). Creatine kinase isoenzymes play a central role in energy transduction in tissues with large, fluctuating energy demands, such as skeletal muscle, heart, brain and spermatozoa.
Gene Name:
CKM
Uniprot ID:
P06732
Molecular weight:
43100.91
Reactions
Adenosine triphosphate + Creatine → ADP + Phosphocreatinedetails