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CHEBI:43263 - 5-iododeoxycytidine monophosphate

ChEBI IDCHEBI:43263
ChEBI Name5-iododeoxycytidine monophosphate
Stars
DefinitionA 2'-deoxycytidine phosphate that is 2'-deoxycytidine-5'-monophosphate in which the hydrogen at position 5 on the cytosine ring is replaced by iodine.
Secondary ChEBI IDsCHEBI:41281, CHEBI:43259, CHEBI:86352
Last Modified20 November 2019
SubmitterBijay
DownloadsMolfile
FormulaC9H13IN3O7P
Net Charge0
Average Mass433.095
Monoisotopic Mass432.95358
SMILESNc1nc(=O)n([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)cc1I
InChIInChI=1S/C9H13IN3O7P/c10-4-2-13(9(15)12-8(4)11)7-1-5(14)6(20-7)3-19-21(16,17)18/h2,5-7,14H,1,3H2,(H2,11,12,15)(H2,16,17,18)/t5-,6+,7+/m0/s1
InChIKeyJYCZFDPCUJKMMG-RRKCRQDMSA-N
ChEBI Ontology
Outgoing Relation(s)
5-iododeoxycytidine monophosphate (CHEBI:43263) has functional parent 2'-deoxycytosine 5'-monophosphate (CHEBI:15918)
5-iododeoxycytidine monophosphate (CHEBI:43263) is a 2'-deoxycytidine phosphate (CHEBI:37092)
5-iododeoxycytidine monophosphate (CHEBI:43263) is a organoiodine compound (CHEBI:37142)
IUPAC Name 
2'-deoxy-5-iodocytidine 5'-(dihydrogen phosphate)
Synonyms  Source
5IdCMPSUBMITTER
5-Iodo-2'-Deoxyuridine-5'-MonophosphateDrugBank
Manual XrefsDatabases
DB02324DrugBank
C38PDBeChem
Registry NumbersSources
Reaxys:569864Reaxys