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CHEBI:16952 - 5-hydroxymethyldeoxycytidylic acid

ChEBI IDCHEBI:16952
ChEBI Name5-hydroxymethyldeoxycytidylic acid
Stars
DefinitionA 2'-deoxycytidine phosphate compound having the phosphate group at the 5'-position and a hydroxymethyl substituent at the 5-position.
Secondary ChEBI IDsCHEBI:2078, CHEBI:12138, CHEBI:20590
Last Modified10 August 2017
DownloadsMolfile
FormulaC10H16N3O8P
Net Charge0
Average Mass337.225
Monoisotopic Mass337.06750
SMILESNc1nc(=O)n([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O)O2)cc1CO
InChIInChI=1S/C10H16N3O8P/c11-9-5(3-14)2-13(10(16)12-9)8-1-6(15)7(21-8)4-20-22(17,18)19/h2,6-8,14-15H,1,3-4H2,(H2,11,12,16)(H2,17,18,19)/t6-,7+,8+/m0/s1
InChIKeyBTIWPBKNTZFNRI-XLPZGREQSA-N
ChEBI Ontology
Outgoing Relation(s)
5-hydroxymethyldeoxycytidylic acid (CHEBI:16952) is a 2'-deoxycytidine phosphate (CHEBI:37092)
5-hydroxymethyldeoxycytidylic acid (CHEBI:16952) is a pyrimidine 2'-deoxyribonucleoside 5'-monophosphate (CHEBI:36995)
5-hydroxymethyldeoxycytidylic acid (CHEBI:16952) is conjugate acid of 5-hydroxymethyldeoxycytidylate(2−) (CHEBI:57962)
Incoming Relation(s)
5-hydroxymethyldeoxycytidylate(2−) (CHEBI:57962) is conjugate base of 5-hydroxymethyldeoxycytidylic acid (CHEBI:16952)
5-hydroxymethyldeoxycytidine 5'-monophosphate residue (CHEBI:137351) is substituent group from 5-hydroxymethyldeoxycytidylic acid (CHEBI:16952)
IUPAC Name 
2'-deoxy-5-(hydroxymethyl)cytidine 5'-(dihydrogen phosphate)
Synonyms  Source
5-HydroxymethyldeoxycytidylateKEGG COMPOUND
2'-Deoxy-5-hydroxymethylcytidine 5'-phosphateKEGG COMPOUND
5-HmdcytChemIDplus
5-Hydroxymethyldeoxycytidylic acidKEGG COMPOUND
Manual XrefsDatabases
C03997KEGG COMPOUND
Registry NumbersSources
Beilstein:47896Beilstein
CAS:13009-95-5ChemIDplus
CAS:13009-95-5KEGG COMPOUND