Record Information
Version 1.0
Update Date 1/22/2018 11:54:54 AM
Metabolite IDPAMDB120475
Identification
Name: cytidine 2',3'-cyclic monophosphate
Description:A 2',3'-cyclic nucleotide(1−) which is obtained from 2',3'-cyclic CMP by removal of a proton from the cyclic phosphate group.
Structure
Thumb
Synonyms:
  • 2',3'-cyclic CMP
  • cytidine 2',3'-cyclic monophosphate (1-)
Chemical Formula: C9H11N3O7P
Average Molecular Weight: 304.176
Monoisotopic Molecular Weight: 305.0413
InChI Key: NMPZCCZXCOMSDQ-XVFCMESISA-M
InChI:InChI=1S/C9H12N3O7P/c10-5-1-2-12(9(14)11-5)8-7-6(4(3-13)17-8)18-20(15,16)19-7/h1-2,4,6-8,13H,3H2,(H,15,16)(H2,10,11,14)/p-1/t4-,6-,7-,8-/m1/s1
CAS number: Not Available
IUPAC Name:cytidine 2',3'-phosphate
Traditional IUPAC Name: Not Available
SMILES:C(C2(C3(C(C(N1(C(N=C(C=C1)N)=O))O2)OP(=O)([O-])O3)))O
Chemical Taxonomy
Taxonomy DescriptionThis compound belongs to the class of organic compounds known as 2',3'-cyclic pyrimidine nucleotides. These are pyrimidine nucleotides in which the oxygen atoms linked to the C2 and C3 carbon atoms of the ribose moiety are both bonded the same phosphorus atom of the phosphate group.
Kingdom Organic compounds
Super ClassNucleosides, nucleotides, and analogues
Class Pyrimidine nucleotides
Sub ClassCyclic pyrimidine nucleotides
Direct Parent 2',3'-cyclic pyrimidine nucleotides
Alternative Parents
Substituents
  • 2',3'-cyclic pyrimidine ribonucleotide
  • Ribonucleoside 3'-phosphate
  • Aminopyrimidine
  • Pyrimidone
  • Hydropyrimidine
  • Monosaccharide
  • Organic phosphoric acid derivative
  • Primary aromatic amine
  • Pyrimidine
  • Imidolactam
  • 1,3_dioxaphospholane
  • Heteroaromatic compound
  • Oxolane
  • Oxacycle
  • Azacycle
  • Organoheterocyclic compound
  • Organic oxide
  • Hydrocarbon derivative
  • Primary alcohol
  • Primary amine
  • Organooxygen compound
  • Organonitrogen compound
  • Amine
  • Alcohol
  • Organic nitrogen compound
  • Organic oxygen compound
  • Organopnictogen compound
  • Organic anion
  • Aromatic heteropolycyclic compound
Molecular Framework Aromatic heteropolycyclic compounds
External Descriptors
  • a pyrimidine-related compound, a nucleoside 2',3'-cyclic phosphate (CPD-3713)
Physical Properties
State: Not Available
Charge:-1
Melting point: Not Available
Experimental Properties: Not Available
Predicted Properties
PropertyValueSource
Molecular Weight304.175 g/molPubChem
XLogP3-AA-3.4 PubChem
Hydrogen Bond Donor Count2 PubChem
Hydrogen Bond Acceptor Count7 PubChem
Rotatable Bond Count2 PubChem
Exact Mass304.033 g/molPubChem
Monoisotopic Mass304.033 g/molPubChem
Topological Polar Surface Area147 A^2PubChem
Heavy Atom Count20 PubChem
Formal Charge-1 PubChem
Complexity541 PubChem
Isotope Atom Count0 PubChem
Defined Atom Stereocenter Count4 PubChem
Undefined Atom Stereocenter Count0 PubChem
Defined Bond Stereocenter Count0 PubChem
Undefined Bond Stereocenter Count0 PubChem
Covalently-Bonded Unit Count1 PubChem
Biological Properties
Cellular Locations: Not Available
Reactions:
Pathways:
    Spectra
    Spectra: Not Available
    References
    References:
    Synthesis Reference: Not Available
    Material Safety Data Sheet (MSDS) Not Available
    External Links:
    ResourceLink
    BIGG39674
    CHEMSPIDER10463760
    CHEBI60877
    PUBCHEM23421172
    LIGAND-CPDC02354